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1.
IUCrdata ; 9(Pt 5): x240463, 2024 May.
Artículo en Inglés | MEDLINE | ID: mdl-38846552

RESUMEN

In the title salt, (C8H20N)8[Mo10O34], the [Mo10O34]8- polyanion is located about an inversion centre and can be considered as a ß-type octa-molybdate anion to which two additional MoO4 tetra-hedra are linked via common corners. The [Mo10O34]8- polyanions are packed in rows extending parallel to [001] and are connected to the di-butyl-ammonium counter-cations through N-H⋯O hydrogen-bonding inter-actions.

2.
Dalton Trans ; 53(21): 9062-9071, 2024 May 28.
Artículo en Inglés | MEDLINE | ID: mdl-38738339

RESUMEN

Two new cyanido-bridged {FeIIMII} double chains were obtained by reacting cyanido anions [M(CN)4]2- with complex cations [FeII(tptz)]2+ (preformed in situ by mixing a hydrated tetrafluoroborate salt of iron(II) and a tptz ligand, tptz = 2,4,6-tri(2-pyridyl)-1,3,5-triazine) having the general formula [FeII(tptz)MII(CN)4]·2H2O·CH3CN, where M = Pd (1) or Pt (2). Additionally, two molecular complexes formulated as [FeII(tptz)2][MII(CN)4]·4.25H2O, where M = Pd (3) or Pt (4), were subsequently obtained from the same reaction, as secondary products. Single crystal X-ray analysis revealed that 1 and 2 are isostructural and crystallize in the P-1 triclinic space group. Their structure consists of a double-chain with a ladder-like topology, in which cyanido-based [M(CN)4]2- metalloligands coordinate, through three CN- ligands and three [FeII(tptz)]2+ complex cations. Compounds 3 and 4 are also isostructural and crystallize in the P1̄ triclinic space group, and the X-ray structural data show the formation of [FeII(tptz)2]2+ and [MII(CN)4]2- ionic units interconnected through H-bonds and π⋯π stacking supramolecular interactions. The static DC magnetic measurements recorded in the temperature range of 2-300 K showed that 1 and 2 exhibit incomplete spin transition on cooling, which is also confirmed by single crystal XRD analysis and Mössbauer spectroscopy. Compounds 3 and 4 are diamagnetic, most likely due to the encapsulation of Fe(II) in a tight pocket formed by two tptz ligands that preserve the low-spin state in the temperature range of 2-400 K.

3.
Dalton Trans ; 53(9): 4251-4259, 2024 Feb 27.
Artículo en Inglés | MEDLINE | ID: mdl-38334952

RESUMEN

Chemical composition is leading among the numerous factors that determine the spin transition properties of coordination compounds. Classic dicyanometallic bridges {M(CN)2}- are commonly used to build Hofmann-like spin-crossover frameworks, but some extended bridges are also synthetically available. In this paper, we describe a successful synthesis of two very similar spin-crossover frameworks that differ in the cyanometallic bridges involved, namely [Fe(etpz)2{Ag(CN)2}2] (1) and {Fe(etpz)2[Ag2(CN)3][Ag(CN)2]} (2) (where etpz = 2-ethylpyrazine). Magnetic and Mössbauer studies demonstrated the occurrence of abrupt one-step high-spin (HS) ↔ low-spin (LS) transitions for both complexes. The spin transition temperatures are T1/2 ↓ = 233 K and T1/2 ↑ = 243 K for 1 and T1/2 ↓ = 188 K and T1/2 ↑ = 191 K for 2 with thermal hysteresis loops of 10 K for 1 and 3 K for 2. The bridging mononuclear [Ag(CN)2]- units and FeII cations assemble to form infinite 2D layers in the structure of 1. Interestingly, compound 2 forms 2D layers of FeII cations bridged by both binuclear [Ag2(CN)3]- and mononuclear [Ag(CN)2]- units. The structures of 1 and 2 comprise different types of intermolecular interactions including Ag⋯Ag and Ag⋯Netpz, which induce the creation of supramolecular 3D frameworks. The synergy between metallophilic interactions and the spin transition is also confirmed by the variation of Ag⋯Ag distances during spin crossover. The characterization of such analogues allowed us to analyze in detail the effect of the cyanometallic bridge on the structure of new frameworks and on the bistability in Hofmann-like complexes.

4.
Chem Biodivers ; 21(5): e202400316, 2024 May.
Artículo en Inglés | MEDLINE | ID: mdl-38422224

RESUMEN

New 1H-1,2,4-triazolyl derivatives were synthesized, and six of them were selected based on docking prediction for the investigation of their antimicrobial activity against five bacterial and eight fungal strains. All compounds demonstrated antibacterial activity with MIC lower than that of the ampicillin and chloramphenicol. In general, the most sensitive bacteria appeared to be P. fluorescens, while the plant pathogen X. campestris was the most resistant. The antifungal activity of the compounds was much better than the antibacterial activity. All compounds were more potent (6 to 45 times) than reference drugs ketoconazole and bifonazole with the best activity achieved by compound 4 a. A. versicolor, A. ochraceus, A.niger, and T.viride showed the highest sensitivity to compound 4 b, while, T. viride, P. funiculosum, and P.ochrochloron showed good sensitivity to compound 4 a. Molecular docking studies suggest that the probable mechanism of antibacterial activity involves the inhibition of the MurB enzyme of E. coli, while CYP51 of C. albicans appears to be involved in the mechanism of antifungal activity. It is worth mentioning that none of the tested compounds violated Lipinski's rule of five.


Asunto(s)
Antibacterianos , Antifúngicos , Pruebas de Sensibilidad Microbiana , Simulación del Acoplamiento Molecular , Triazoles , Triazoles/química , Triazoles/farmacología , Triazoles/síntesis química , Antifúngicos/farmacología , Antifúngicos/química , Antifúngicos/síntesis química , Relación Estructura-Actividad , Antibacterianos/farmacología , Antibacterianos/química , Antibacterianos/síntesis química , Hongos/efectos de los fármacos , Bacterias/efectos de los fármacos , Estructura Molecular , Relación Dosis-Respuesta a Droga , Escherichia coli/efectos de los fármacos , Antiinfecciosos/farmacología , Antiinfecciosos/química , Antiinfecciosos/síntesis química
5.
Molecules ; 29(4)2024 Feb 07.
Artículo en Inglés | MEDLINE | ID: mdl-38398524

RESUMEN

6-Iodo-substituted carboxy-quinolines were obtained using a one-pot, three-component method with trifluoroacetic acid as a catalyst under acidic conditions. Iodo-aniline, pyruvic acid and 22 phenyl-substituted aldehydes (we varied the type and number of radicals) or O-heterocycles, resulting in different electronic effects, were the starting components. This approach offers advantages such as rapid response times, cost-effective catalysts, high product yields and efficient purification procedures. A comprehensive investigation was conducted to examine the impact of aldehyde structure on the synthesis pathway. A library of compounds was obtained and characterized by FT-IR, MS, 1H NMR and 13C NMR spectroscopy and single-ray crystal diffractometry. Their antimicrobial activity against S. epidermidis, K. pneumonie and C. parapsilosis was tested in vitro. The effect of iodo-quinoline derivatives on microbial adhesion, the initial stage of microbial biofilm development, was also investigated. This study suggests that carboxy-quinoline derivatives bearing an iodine atom are interesting scaffolds for the development of novel antimicrobial agents.


Asunto(s)
Antiinfecciosos , Yodo , Quinolinas , Espectroscopía Infrarroja por Transformada de Fourier , Antiinfecciosos/química , Quinolinas/química
6.
Acta Crystallogr E Crystallogr Commun ; 80(Pt 1): 25-28, 2024 Jan 01.
Artículo en Inglés | MEDLINE | ID: mdl-38312161

RESUMEN

The synthetic availability of mol-ecular water oxidation catalysts containing high-valent ions of 3d metals in the active site is a prerequisite to enabling photo- and electrochemical water splitting on a large scale. Herein, the synthesis and crystal structure of di-ammonium {µ-1,3,4,7,8,10,12,13,16,17,19,22-dodeca-aza-tetra-cyclo-[8.8.4.13,17.18,12]tetra-cosane-5,6,14,15,20,21-hexa-onato}ferrate(IV) acetic acid tris-olvate, (NH4)2[FeIV(C12H12N12O6)]·3CH3COOH or (NH4)2[FeIV(L-6H)]·3CH3COOH is reported. The FeIV ion is encapsulated by the macropolycyclic ligand, which can be described as a dodeca-aza-quadricyclic cage with two capping tri-aza-cyclo-hexane fragments making three five- and six six-membered alternating chelate rings with the central FeIV ion. The local coord-ination environment of FeIV is formed by six deprotonated hydrazide nitro-gen atoms, which stabilize the unusual oxidation state. The FeIV ion lies on a twofold rotation axis (multiplicity 4, Wyckoff letter e) of the space group C2/c. Its coordination geometry is inter-mediate between a trigonal prism (distortion angle φ = 0°) and an anti-prism (φ = 60°) with φ = 31.1°. The Fe-N bond lengths lie in the range 1.9376 (13)-1.9617 (13) Å, as expected for tetra-valent iron. Structure analysis revealed that three acetic acid mol-ecules additionally co-crystallize per one iron(IV) complex, and one of them is positionally disordered over four positions. In the crystal structure, the ammonium cations, complex dianions and acetic acid mol-ecules are inter-connected by an intricate system of hydrogen bonds, mainly via the oxamide oxygen atoms acting as acceptors.

7.
Acta Crystallogr E Crystallogr Commun ; 80(Pt 1): 54-57, 2024 Jan 01.
Artículo en Inglés | MEDLINE | ID: mdl-38312166

RESUMEN

The title compound, [Cu(HL)2(H2O)2] or [Cu(C4H4N3O2)2(H2O)2], is a mononuclear octa-hedral CuII complex based on 5-methyl-1H-1,2,4-triazole-3-carb-oxy-lic acid (H2 L). [Cu(HL)2(H2O)2] was synthesized by reaction of H2 L with copper(II) nitrate hexa-hydrate (2:1 stoichiometric ratio) in water under ambient conditions to produce clear light-blue crystals. The central Cu atom exhibits an N2O4 coordination environment in an elongated octa-hedral geometry provided by two bidentate HL - anions in the equatorial plane and two water mol-ecules in the axial positions. Hirshfeld surface analysis revealed that the most important contributions to the surface contacts are from H⋯O/O⋯H (33.1%), H⋯H (29.5%) and H⋯N/N⋯H (19.3%) inter-actions.

8.
Chem Mater ; 35(22): 9725-9738, 2023 Nov 28.
Artículo en Inglés | MEDLINE | ID: mdl-38047186

RESUMEN

Hybrid organic-inorganic lead halide perovskites are promising candidates for next-generation solar cells, light-emitting diodes, photodetectors, and lasers. The structural, dynamic, and phase-transition properties play a key role in the performance of these materials. In this work, we use a multitechnique experimental (thermal, X-ray diffraction, Raman scattering, dielectric, nonlinear optical) and theoretical (machine-learning force field) approach to map the phase diagrams and obtain information on molecular dynamics and mechanism of the structural phase transitions in novel 3D AZRPbX3 perovskites (AZR = aziridinium; X = Cl, Br, I). Our work reveals that all perovskites undergo order-disorder phase transitions at low temperatures, which significantly affect the structural, dielectric, phonon, and nonlinear optical properties of these compounds. The desirable cubic phases of AZRPbX3 remain stable at lower temperatures (132, 145, and 162 K for I, Br, and Cl) compared to the methylammonium and formamidinium analogues. Similar to other 3D-connected hybrid perovskites, the dielectric response reveals a rather high dielectric permittivity, an important feature for defect tolerance. We further show that AZRPbBr3 and AZRPbI3 exhibit strong nonlinear optical absorption. The high two-photon brightness of AZRPbI3 emission stands out among lead perovskites emitting in the near-infrared region.

9.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 11): 988-992, 2023 Nov 01.
Artículo en Inglés | MEDLINE | ID: mdl-37936838

RESUMEN

A mononuclear square-planar CuII complex of (5-methyl-1H-pyrazol-3-yl)carbamate, [Cu(C5H6N3O2)2]·4H2O, was synthesized using a one-pot reaction from 5-methyl-3-pyrazolamine and copper(II) acetate in water under ambient conditions. The adsorption of carbon dioxide from air was facilitated by the addition of di-ethano-lamine to the reaction mixture. While di-ethano-lamine is not a component of the final product, it plays a pivotal role in the reaction by creating an alkaline environment, thereby enabling the adsorption of atmos-pheric carbon dioxide. The central copper(II) atom is in an (N2O2) square-planar coordination environment formed by two N atoms and two O atoms of two equivalent (5-methyl-1H-pyrazol-3-yl)carbamate ligands. Additionally, there are co-crystallized water mol-ecules within the crystal structure of this compound. These co-crystallized water mol-ecules are linked to the CuII mononuclear complex by O-H⋯O hydrogen bonds. According to Hirshfeld surface analysis, the most frequently observed weak inter-molecular inter-actions are H⋯O/O⋯H (33.6%), H⋯C/C⋯H (11.3%) and H⋯N/N⋯H (9.0%) contacts.

10.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 11): 1059-1062, 2023 Nov 01.
Artículo en Inglés | MEDLINE | ID: mdl-37936846

RESUMEN

The title compound, [FeLi2(C12H12N12O6)(H2O)4]·4H2O, consists of iron complex anions, lithium cations and water mol-ecules. The complex anion shows a clathrochelate topology. The coordination geometry of the FeIV centre is inter-mediate between a trigonal prism and a trigonal anti-prism. In the crystal, the complex anions are connected through two Li cations into dimers, which are connected by Li-O bonds, forming infinite chains along the b-axis direction.

11.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 11): 977-981, 2023 Nov 01.
Artículo en Inglés | MEDLINE | ID: mdl-37936849

RESUMEN

The crystal structure of the title salt, bis-(3-carb-oxy-1-methyl-pyridinium) octa-bromide, 2C7H8NO2 +·Br8 2-, consists of 3-carb-oxy-1-methyl-pyridinium (N-methyl-nicotinic acid) cations, which are stacked between relatively rare [Br8]2- anions. The polybromide [Br8]2- anion has point group symmetry and can be described as being composed of two [Br3]- anions connected with a Br2 mol-ecule in a Z-shaped manner. Contacts between neighboring octa-bromide anions ensure the creation of pseudo-polymeric chains propagating along [111]. The organic cations are located between anionic chains and are connected to each other through O-H⋯O hydrogen bonds and to the [Br8]2- anions through π⋯Br inter-actions that induce the creation of a supra-molecular tri-periodic network. In addition, the presence of weak C-H⋯Br contacts leads to the creation of layers, which align parallel to (11).

12.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 10): 962-966, 2023 Oct 01.
Artículo en Inglés | MEDLINE | ID: mdl-37817956

RESUMEN

The unit cell of the title compound, [Fe(C18H15N6O2)2]·2CH3OH·2CHCl3, consists of a charge-neutral complex mol-ecule, two methanol and two chloro-form mol-ecules. In the complex, the two tridentate 2-(5-(3,4-di-meth-oxy-phen-yl)-1,2,4-triazol-3-yl)-6-(pyrazol-1-yl)pyridine ligands coordinate to the central FeII ion through the N atoms of the pyrazole, pyridine and triazole groups, forming a pseudo-octa-hedral coordination sphere. Neighbouring tapered mol-ecules are linked through weak C-H(pz)⋯π(ph) inter-actions into one-dimensional chains, which are joined into two-dimensional layers through weak C-H⋯N/C/O inter-actions. Furthermore, the layers stack in a three-dimensional network linked by weak inter-layer C-H⋯π inter-actions of the meth-oxy and phenyl groups. The inter-molecular contacts were qu-anti-fied using Hirshfeld surface analysis and two-dimensional fingerprint plots, revealing the relative contributions of the contacts to the crystal packing to be H⋯H 32.0%, H⋯C/C⋯H 26.3%, H⋯N/N⋯H 13.8%, and H⋯O/O⋯H 7.5%. The average Fe-N bond distance is 2.185 Å, indicating the high-spin state of the FeII ion. Energy framework analysis at the HF/3-21 G theory level was performed to qu-antify the inter-action energies in the crystal structure.

13.
Molecules ; 28(20)2023 Oct 12.
Artículo en Inglés | MEDLINE | ID: mdl-37894539

RESUMEN

In terrestrial plants, strigolactones act as multifunctional endo- and exo-signals. On microalgae, the strigolactones determine akin effects: induce symbiosis formation with fungi and bacteria and enhance photosynthesis efficiency and accumulation of biomass. This work aims to synthesize and identify strigolactone mimics that promote photosynthesis and biomass accumulation in microalgae with biotechnological potential. Novel strigolactone mimics easily accessible in significant amounts were prepared and fully characterized. The first two novel compounds contain 3,5-disubstituted aryloxy moieties connected to the bioactive furan-2-one ring. In the second group of compounds, a benzothiazole ring is connected directly through the cyclic nitrogen atom to the bioactive furan-2-one ring. The novel strigolactone mimics were tested on Chlorella sorokiniana NIVA-CHL 176. All tested strigolactones increased the accumulation of chlorophyll b in microalgae biomass. The SL-F3 mimic, 3-(4-methyl-5-oxo-2,5-dihydrofuran-2-yl)-3H-benzothiazol-2-one (7), proved the most efficient. This compound, applied at a concentration of 10-7 M, determined a significant biomass accumulation, higher by more than 15% compared to untreated control, and improved the quantum yield efficiency of photosystem II. SL-F2 mimic, 5-(3,5-dibromophenoxy)-3-methyl-5H-furan-2-one (4), applied at a concentration of 10-9 M, improved protein production and slightly stimulated biomass accumulation. Potential utilization of the new strigolactone mimics as microalgae biostimulants is discussed.


Asunto(s)
Chlorella , Microalgas , Chlorella/metabolismo , Biomasa , Fotosíntesis , Microalgas/metabolismo , Furanos/farmacología , Furanos/metabolismo
14.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 9): 821-826, 2023 Sep 01.
Artículo en Inglés | MEDLINE | ID: mdl-37693660

RESUMEN

The asymmetric units of the isostructural compounds (1,4,8,11-tetra-aza-cyclo-tetra-decane-κ4 N)nickel(II) tetra-iodido-cadmate(II), [Ni(C10H24N4)][CdI4] (I), and tri-iodido-1κ3 I-µ-iodido-(1,4,8,11-tetra-aza-cyclo-tetra-decane-2κ4 N)cad-mium(II)zinc(II), [CdZnI4(C10H24N4)] (II) (C10H24N4 = 1,4,8,11-tetra-aza-cyclo-tetra-decane, cyclam, L), consist of the centrosymmetric macrocyclic cation [M(L)]2+ [M = NiII or ZnII] with the metal ion lying on a twofold screw axis, and the tetra-iodo-cadmate anion [CdI4]2- located on the mirror plane. In I, the anion acts as an uncoordinated counter-ion while in II it is bound to the ZnII atom via one of the iodide atoms, thus forming an electroneutral heterobimetallic complex [Zn(L)(CdI4)]. The NiII and ZnII ions are coordinated in a square-planar manner by the four secondary N atoms of the macrocyclic ligand L, which adopts the most energetically stable trans-III conformation. The [CdI4]2- anions in I and II are structurally very similar and represent slightly deformed tetra-hedrons with average Cd-I bond lengths and I-Cd-I angles of ca 2.79 Šand 109.6°, respectively. The supra-molecular organization of the complexes under consideration in the crystals is very similar and is determined by the hydrogen-bonding inter-actions between the secondary amino groups of the ligand L in the [M(L)]2+ cations and iodide atoms of the [CdI4]2- anion. In particular, the alternating cations and anions form chains running along the b-axis direction that are arranged into di-periodic sheets oriented parallel to the (101) and (01) planes. Because both kinds of sheets are built from the same cations and anions, this feature provides the three-dimensional coherence of the crystals of I and II.

15.
Future Med Chem ; 15(15): 1369-1391, 2023 Aug.
Artículo en Inglés | MEDLINE | ID: mdl-37577781

RESUMEN

Aim: A series of new hybrid molecules with two iodine atoms on the sides were synthesized. Methods: A one-pot, two-component method with trifluoroacetic acid as an effective catalyst to obtain dihydro-pyrrol-2-one compounds was developed. Short reaction times, a cheap catalyst, high yields and clean work-up are benefits of this method. Results: The chemical structures of the newly synthesized compounds were verified through spectroscopic techniques. Their antimicrobial activity against Staphylococcus aureus, Pseudomonas aeruginosa and Candida albicans was tested in vitro. Conclusion: NC- and OH- radicals confer broad-spectrum antimicrobial activity, including against Gram-positive and Gram-negative bacteria and yeasts. Compounds 3g >7 and >9 were most active on the two bacterial species, while 3l >9 and >3i were most active against the fungal strain.

16.
Dalton Trans ; 52(30): 10545-10556, 2023 Aug 01.
Artículo en Inglés | MEDLINE | ID: mdl-37458339

RESUMEN

Lead halide hybrid perovskites incorporating chiral organic cations attract considerable attention due to their promising application in multifarious optoelectronic devices. However, the examples of chiral hybrid perovskites are still limited, which greatly impedes their further studies in various optoelectronic fields. Herein, we report on new low-dimensional lead-halide hybrid perovskites incorporating the enantiopure chiral α-amino acid L-proline. Two hybrid perovskites (L-proH)PbBr3·H2O (Pro-PbBr3) and (L-proH)4Pb3Br10·4H2O (Pro-Pb3Br10) have been synthesized by employing different ratios of organic and inorganic precursors. According to structural analysis, the inorganic sublattice of compound Pro-PbBr3 is built of one-dimensional (1D) [PbX3]∞n- lead halide chains, whereas the inorganic sublattice of compound Pro-Pb3Br10 is built upon a rare two-dimensional (2D) [Pb3Br10]∞4n- honeycomb-type inorganic framework. Hirshfeld surface analysis revealed an important role of various hydrogen bonding interactions in providing the binding between organic and inorganic parts of these hybrid perovskites. The optical band gap values of new hybrid perovskites as estimated using the Tauc plot approach are 4.19 eV (Pro-PbBr3) and 4.13 eV (Pro-Pb3Br10). Also, new compounds display low-temperature broadband photoluminescence which can be attributed to the self-trapped excitons. These results show the potential of α-proline for constructing novel and highly demanded chiral hybrid perovskites, which will hold great promise for further optoelectronic applications.

17.
Int J Mol Sci ; 24(14)2023 Jul 19.
Artículo en Inglés | MEDLINE | ID: mdl-37511401

RESUMEN

New pyrrolo[1,2-b]pyridazines were synthesized by 3 + 2 cycloaddition reaction between mesoionic oxazolo-pyridazinones and methyl/ethyl propiolate. The mesoionic compounds were generated in situ by action of acetic anhydride on 3(2H)pyridazinone acids obtained from corresponding esters by alkaline hydrolysis followed by acidification. The structures of the compounds were confirmed by elemental analyses and IR, 1H-NMR, 13C-NMR, and X-ray diffraction data. The regioselectivity of cycloaddition was evidenced by NMR spectroscopy and confirmed by X-ray analysis. The compounds were evaluated for their cytotoxicity on plant cells (Triticum aestivum L.) and crustacean animal cells (Artemia franciscana Kellogg and Daphnia magna Straus). The results indicated that the tested compounds exhibited low toxicity on the plant cell (IC50 values higher than 200 µM), while on Artemia nauplii no lethality was observed. Daphnia magna assay showed that pyrrolo[1,2-b]pyridazines 5a and 5c could exhibit toxic effects, whereas, for the other compounds, toxicity was low to moderate. Also, the cytotoxic effects of the compounds were tested on three human adenocarcinoma-derived adherent cell lines (colon LoVo, ovary SK-OV-3, breast MCF-7). The in vitro compound-mediated cytotoxicity assays, performed by the MTS technique, demonstrated dose- and time-dependent cytotoxic activity for several compounds, the highest anti-tumor activity being observed for 5a, 2c, and 5f, especially against colon cancer cells.


Asunto(s)
Antineoplásicos , Piridazinas , Animales , Humanos , Estructura Molecular , Relación Estructura-Actividad , Piridazinas/química , Ensayos de Selección de Medicamentos Antitumorales , Proliferación Celular , Antineoplásicos/química
18.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 5): 432-435, 2023 Apr 01.
Artículo en Inglés | MEDLINE | ID: mdl-37151835

RESUMEN

The title compound, bis-[µ-3-ethyl-5-(pyridin-2-yl)-1H-1,2,4-triazol-1-ido]bis[acetato-(di-methyl-formamide)-copper(II)], [Cu2(C9H9N4)2(C2H3O2)2(C3H7NO)2] or [Cu2(L Et)2(OAc)2(dmf)2], is a triazolate complex, which contains two 3-(2-pyrid-yl)-5-ethyl-triazolates (L Et)- in bidentate-bridged coordination modes. Both copper atoms are involved in the formation of a planar six-membered metallocycle Cu-[N-N]2-Cu. The inversion center of the complex is located at the mid-point of the Cu⋯Cu vector. Each CuII atom has a distorted trigonal-bipyramidal environment formed by the three nitro-gen atoms of the deprotonated bridging 3-(2-pyrid-yl)-5-ethyl-triazolate unit, oxygen atoms of the OAc- group and dmf mol-ecule. In the crystal, C-H⋯O hydrogen bonds link the mol-ecules into chains running along the c-axis direction.

19.
Chem Commun (Camb) ; 59(24): 3566-3569, 2023 Mar 21.
Artículo en Inglés | MEDLINE | ID: mdl-36880308

RESUMEN

3D hybrid perovskites based upon small organic cations gave start to a new intensively growing class of semiconducting materials. Here we report on the elaboration of quantum dots of a recently emerged new perovskite (AzrH)PbBr3 (AzrH = aziridinium cation). By employing the antisolvent precipitation technique and stabilization with a cationic surfactant we succeeded in obtaining quantum dots that display tunable luminescence. This piece of work shows the perspective of aziridinium-based materials for the elaboration of advanced photonic nanostructures.

20.
Molecules ; 28(3)2023 Jan 17.
Artículo en Inglés | MEDLINE | ID: mdl-36770601

RESUMEN

Herein we report a feasible study concerning the synthesis and the in vitro antimicrobial activity of some new homodrimane sesquiterpenoids with a benzimidazole unit. Based on some homodrimane carboxylic acids, on their acyl chlorides and intermediate monoamides, a series of seven N-homodrimenoyl-2-amino-1,3-benzimidazoles and 2-homodrimenyl-1,3-benzimidazoles was synthesized. The syntheses involved the decarboxylative cyclization and condensation of the said acids or acyl chlorides with o-phenylendiamine and 2-aminobenzimidazole, as well as the p-TsOH-mediated cyclodehydration of the said monoacylamides. The structures of the synthesized compounds have been fully confirmed, including by the X-ray diffraction. Their biological activities were evaluated on five species of fungi (Aspergillus niger, Fusarium solani, Penicillium chrysogenum, P. frequentans, and Alternaria alternata) and two strains of bacteria (Bacillus sp. and Pseudomonas aeruginosa). Compounds 7 and 20 showed higher antifungal (MIC = 0.064 and 0.05 µg/mL) and antibacterial (MIC = 0.05 and 0.032 µg/mL) activities compared to those of the standards: caspofungin (MIC = 0.32 µg/mL) and kanamycin (MIC = 2.0 µg/mL), and compounds 4, 10, 14, and 19 had moderate activities.


Asunto(s)
Antifúngicos , Hongos , Antifúngicos/química , Antibacterianos/química , Bencimidazoles/química , Aspergillus niger , Pruebas de Sensibilidad Microbiana , Relación Estructura-Actividad
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