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1.
Acta Crystallogr E Crystallogr Commun ; 80(Pt 6): 663-666, 2024 May 01.
Artigo em Inglês | MEDLINE | ID: mdl-38845707

RESUMO

The chemical reaction of 4-bromo-benzoyl-chloride and 2-amino-thia-zole in the presence of potassium thio-cyanate yielded a white solid formulated as C15H10BrN3OS2, which consists of 4-bromo-benzamido and 2-benzo-thia-zolyl moieties connected by a thio-urea group. The 4-bromo-benzamido and 2-benzo-thia-zolyl moieties are in a trans conformtion (sometimes also called s-trans due to the single bond) with respect to the N-C bond. The dihedral angle between the mean planes of the 4-bromo-phenyl and the 2-benzo-thia-zolyl units is 10.45 (11)°. The thio-urea moiety, -C-NH-C(=S) -NH- fragment forms a dihedral angle of 8.64 (12)° with the 4-bromo-phenyl ring and is almost coplanar with the 2-benzo-thia-zolyl moiety, with a dihedral angle of 1.94 (11)°. The mol-ecular structure is stabilized by intra-molecular N-H⋯O hydrogen bonds, resulting in the formation of an S(6) ring. In the crystal, pairs of adjacent mol-ecules inter-act via inter-molecular hydrogen bonds of type C-H⋯N, C-H⋯S and N-H⋯S, resulting in mol-ecular layers parallel to the ac plane.

2.
Acta Crystallogr E Crystallogr Commun ; 80(Pt 2): 133-136, 2024 Feb 01.
Artigo em Inglês | MEDLINE | ID: mdl-38333124

RESUMO

The reaction of the Schiff base 2-[1-(pyridin-2-yl)ethyl-idene-amino]-ethanol (HL), which is formed by reaction of 2-amino-ethanol and 2-acetyl-pyridine with CuBr2 in ethanol results in the isolation of the new polymeric complex poly[hexa-µ-bromido-bis-{2-[1-(pyridin-2-yl)ethyl-idene-amino]-ethano-lato}tetra-copper(II)], [Cu4Br6(C9H11N2O)2]n or [Cu4Br6 L 2]n. The asymmetric unit of the crystal structure of the polymeric [Cu4Br6 L 2]n complex is composed by four copper (II) cations, two monodeprotonated mol-ecules of the ligand, and six bromide anions, which act as bridges. The ligand mol-ecules act in a tridentate fashion through their azomethine nitro-gen atoms, their pyridine nitro-gen atoms, and their alcoholate O atoms. The crystal structure shows two types of geometries in the coordination polyhedrons around Cu2+ ions. Two copper cations are situated in a square-based pyramidal environment, while the two other copper cations adopt a tetra-hedral geometry. Bromides anions acting as bridges between two metal ions connect the units, resulting in a tetra-nuclear polymer compound.

3.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 2): 74-78, 2023 Jan 01.
Artigo em Inglês | MEDLINE | ID: mdl-36793402

RESUMO

Two new heterocyclic 1,2,3-triazenes were synthesized by diazo-tation of 3-amino-pyridine following respectively by coupling with morpholine or 1,2,3,4-tetra-hydro-quinoline. 4-[(Pyridin-3-yl)diazen-yl]morpholine (I), C9H12N4O, has monoclinic P21/c symmetry at 100 K, while 1-[(pyridin-3-yl)diazen-yl]-1,2,3,4-tetra-hydro-quinoline (II), C14H14N4, has monoclinic P21/n symmetry at 100 K. These 1,2,3-triazene derivatives were synthesized by the organic medium method by coupling reactions of 3-amino-pyridine with morpholine and 1,2,3,4-tetra-hydro-quinoline, respectively, and characterized by 1H NMR, 13C NMR, IR, mass spectrometry, and single-crystal X-ray diffraction. The mol-ecule of compound I consists of pyridine and morpholine rings connected by an azo moiety (-N=N-). In the mol-ecule of II, the pyridine ring and the 1,2,3,4-tetra-hydro-quinoline unit are also connected by an azo moiety. The double- and single-bond distances in the triazene chain are comparable for the two compounds. In both crystal structures, the mol-ecules are connected by C-H⋯N inter-actions, forming infinite chains for I and layers parallel to the bc plane for II.

4.
Acta Crystallogr E Crystallogr Commun ; 79(Pt 12): 1109-1114, 2023 Dec 01.
Artigo em Inglês | MEDLINE | ID: mdl-38313129

RESUMO

We report the synthesis and structures of two transition-metal complexes involving 2-(2-hy-droxy-phen-yl)benzimidazole (2hpbi - a ligand of inter-est for its photoluminescent applications), with cobalt, namely, bis-[µ-2-(1H-1,3-benzo-diazol-2-yl)phenolato]bis-[ethanol(thio-cyanato)-cobalt(II)], [Co2(C13H9N2O)2(NCS)2(C2H6O)2], (1), and manganese, namely, bis-[µ-2-(1H-1,3-benzo-diazol-2-yl)phenolato]bis-{[2-(1H-1,3-benzo-diazol-2-yl)phenolato](thio-cyanato)-mang-an-ese(III)} dihydrate, [Mn2(C13H9N2O)4(NCS)2]·2H2O, (2). These structures are two recent examples of a fruitful collaboration between researchers at the Laboratoire de Chimie de Coordination Organique/Organic Coordination Chemistry Laboratory (LCCO), University of Dakar, Senegal and the National Crystallography Service (NCS), School of Chemistry, University Southampton, UK. This productive partnership was forged through meeting at Pan-African Conferences on Crystallography and quickly grew as the plans for the AfCA (African Crystallographic Association) developed. This article therefore also showcases this productive partnership, in celebration of the IUCr's 75 year anniversary and the recent inclusion of AfCA as a Regional Associate of the IUCr.

5.
Acta Crystallogr E Crystallogr Commun ; 78(Pt 10): 1072-1076, 2022 Oct 01.
Artigo em Inglês | MEDLINE | ID: mdl-36250123

RESUMO

This article reports a practical synthesis of tert-butyl acetyl-carbamate, C7H13NO3, from N-Boc-thio-acetamide and the study of its crystal structure. The reaction proceeds in the presence of natural phosphate as a catalyst, with excellent yield, simple workup and benign environment. The crystal structure was refined using a transferred multipolar atom model. In the crystal, symmetrical pairs of strong N-H⋯O hydrogen bonds connect the mol-ecules into dimers with an R 2 2(8) ring motif. The inter-actions between neighbouring dimers are mostly van der Waals, between hydro-phobic methyl groups. Hirshfeld surface analysis shows the major contributions to the crystal packing are from H⋯H (42.6%) and O⋯H (26.7%) contacts.

6.
Acta Crystallogr E Crystallogr Commun ; 78(Pt 4): 349-353, 2022 Apr 01.
Artigo em Inglês | MEDLINE | ID: mdl-35492279

RESUMO

The title mol-ecular structure, namely, (µ3-acetato)(µ2-acetato)-bis-(µ3-1,3-bis-{[1-(2-oxidophen-yl)ethyl-idene]amino}-propan-2-olato)tetra-copper(II) monohydrate, [Cu4(C19H19N2O3)2(CH3CO2)2]·H2O, corresponds to a non-symmetric tetra-nuclear copper complex. The complex exhibits one ligand mol-ecule that connects two copper CuII metal centres via its ethano-lato oxygen anion acting in a µ2-mode and one ligand mol-ecule that connects three copper CuII metal centres via its ethano-lato oxygen anion acting in a µ3-mode. One bridging acetate group acting in an η1:η1-µ2-mode connects two copper(II) ions while another bridging acetate group connects three copper(II) ions in an η1:-η2-µ3-mode. A chair-like Cu3O3 structure is generated in which the two CuO4N units are connected by one µ2-O ethano-late oxygen atom. These two units are connected respectively to the CuO3N unit via one µ3-O ethano-late oxygen atom and one µ2-O atom from an acetate group. The µ3-O atom also connects one of the CuO4N units and the CuO3N unit to another CuO3N unit, which is out of the chair-like structure. Each of the two penta-coordinated CuII cations has a distorted NO4 square-pyramidal environment. The geometry of each of the two CuNO3 units is best described as a slightly square-planar environment. A series of intra-molecular O-H⋯O hydrogen bonds is observed. In the crystal, the units are connected by inter-molecular C-H⋯O and O-H⋯O hydrogen bonds, thus forming sheets parallel to the ac plane.

7.
Acta Crystallogr E Crystallogr Commun ; 77(Pt 7): 708-713, 2021 Jul 01.
Artigo em Inglês | MEDLINE | ID: mdl-34513016

RESUMO

The title mol-ecular structure, namely, di-aqua-tris-(µ3-1,3-bis-{[1-(2-oxidophen-yl)ethyl-idene]amino}-propan-2-olato)-µ3-hydroxido-dinitrato-hexa-copper(II) ethanol tris-olvate, [Cu6(C19H19N2O3)3(NO3)2(OH)(H2O)2]·3C2H5OH, corres-ponds to a non-symmetric hexa-nuclear copper complex. The complex exhibits one core in which three CuII metal centres are mutually inter-connected, two by two, via three phenolato oxygen anions acting in a µ2-mode. These three copper cations are inter-connected in a µ3-mode by one hydroxyl group. An open-cube structure is generated in which each of the CuII cations of the three CuO4N units is connected by two µ2-O anions from phenolate groups and one µ3-O atom from a hy-droxy anion. Each of the three penta-coordinated CuII cations situated in the open-cube unit has a distorted NO4 square-pyramidal environment. Each of these three CuII centres is inter-connected with another CuII cation via one enolate O atom in µ2-mode, yielding one CuNO4 unit and two CuNO3 units. The penta-coordinated CuII atom has a distorted square-pyramidal environment while the two tetra-coordinated copper(II) cations are situated in a square-planar environment. A series of intra-molecular O-H⋯O hydrogen bonds are observed. In the crystal, the units are connected two by two by inter-molecular C-H⋯O and O-H⋯O hydrogen bonds, thus forming sheets parallel to the ac plane.

8.
Acta Crystallogr E Crystallogr Commun ; 76(Pt 8): 1349-1352, 2020 Aug 01.
Artigo em Inglês | MEDLINE | ID: mdl-32844027

RESUMO

A tetra-nuclear ZnII complex, [Zn4(C13H11N6O)2Cl6(H2O)2] or {[Zn2(HL)(H2O)(Cl2)](µCl)2[Zn2(HL)(H2O)(Cl)]}2, was synthesized by mixing an equimolar amount of a methanol solution containing ZnCl2 and a methanol solution containing the ligand H2 L [1,5-bis-(pyridin-2-yl-methyl-ene)carbono-hydrazide]. In the tetra-nuclear complex, each of the two ligand mol-ecules forms a dinuclear unit that is connected to another dinuclear unit by two bridging chloride anions. In each dinuclear unit, one ZnII cation is penta-coordinated in a N2OCl2 in a distorted square-pyramidal geometry, while the other ZnII cation is hexa-coordinated in a N3OCl2 environment with a distorted octa-hedral geometry. The basal plane around the penta-coordinated ZnII cation is formed by one chloride anion, one oxygen atom, one imino nitro-gen atom and one pyridine nitro-gen atom with the apical position occupied by a chloride anion. The basal plane of the hexa-coordinated ZnII cation is formed by one chloride anion, one hydrazinyl nitro-gen atom, one imino nitro-gen atom and one pyridine nitro-gen atom with the apical positions occupied by a water oxygen atom and a bridged chloro anion from another dinuclear unit, leading to a tetra-nuclear complex. A series of intra-molecular C-H⋯Cl hydrogen bonds is observed in each tetra-nuclear unit. In the crystal, the tetra-nuclear units are connected by inter-molecular C-H⋯Cl, C-H⋯O and N-H⋯O hydrogen bonds, forming a planar two-dimensional structure in the ac plane.

9.
Acta Crystallogr E Crystallogr Commun ; 76(Pt 5): 660-663, 2020 May 01.
Artigo em Inglês | MEDLINE | ID: mdl-32431928

RESUMO

The condensation of 2-furoic hydrazide and 4-dimethyl amino-benzaldehyde in ethanol yielded a yellow solid formulated as the title compound, C14H15N3O2·H2O. The crystal packing is stabilized by inter-molecular O(water)-H⋯O,N(carbohydrazide) and N-H⋯O(water) hydrogen bonds, which form a two-dimensional network along the bc plane. Additional C-H⋯O inter-actions link the mol-ecules into a three-dimensional network. The dihedral angle between the mean planes of the benzene and the furan ring is 34.47 (6)°. The carbohydrazide moiety, i.e., the C=N-N-C=O fragment and the benzene ring are almost coplanar, with an angle of 6.75 (9)° between their mean planes.

10.
Acta Crystallogr E Crystallogr Commun ; 75(Pt 7): 1069-1075, 2019 Jul 01.
Artigo em Inglês | MEDLINE | ID: mdl-31392027

RESUMO

Two CuII complexes [Cu(C14H13N4O2)Cl] n , I, and [Cu4(C8H10NO2)4Cl4] n , II, have been synthesized. In the structure of the mononuclear complex I, each ligand is coordinated to two metal centers. The basal plane around the CuII cation is formed by one chloride anion, one oxygen atom, one imino and one pyridine nitro-gen atom. The apical position of the distorted square-pyramidal geometry is occupied by a pyridine nitro-gen atom from a neighbouring unit, leading to infinite one-dimensional polymeric chains along the b-axis direction. Each chain is connected to adjacent chains by inter-molecular C-H⋯O and C-H⋯Cl inter-actions, leading to a three-dimensional network structure. The tetra-nuclear complex II lies about a crystallographic inversion centre and has one core in which two CuII metal centers are mutually inter-connected via two enolato oxygen atoms while the other two CuII cations are linked by a chloride anion and an enolato oxygen. An open-cube structure is generated in which the two open-cube units, with seven vertices each, share a side composed of two CuII ions bridged by two enolato oxygen atoms acting in a µ3-mode. The CuII atoms in each of the two CuO3NCl units are connected by one µ2-O and two µ3-O atoms from deprotonated hydroxyl groups and one chloride anion to the three other CuII centres. Each of the penta-coordinated CuII cations has a distorted NO3Cl square-pyramidal environment. The CuII atoms in each of the two CuO2NCl2 units are connected by µ2-O and µ3-O atoms from deprotonated alcohol hy-droxy groups and one chloride anion to two other CuII ions. Each of the penta-coordinated CuII cations has a distorted NO2Cl2 square-pyramidal environment. In the crystal, a series of intra-molecular C-H⋯O and C-H⋯Cl hydrogen bonds are observed in each tetra-nuclear monomeric unit, which is connected to four tetra-nuclear monomeric units by inter-molecular C-H⋯O hydrogen bonds, thus forming a planar two-dimensional structure in the (01) plane.

11.
Acta Crystallogr E Crystallogr Commun ; 75(Pt 5): 642-645, 2019 May 01.
Artigo em Inglês | MEDLINE | ID: mdl-31110803

RESUMO

The reaction of benzoyl chloride and ethyl-endi-amine in the presence of potassium thio-cyanate yielded a white solid, C18H18N4O2S2, which consists of two benzoyl-thio-ureido moieties connected by an ethyl-ene chain. The asymmetric unit consists of one half of the mol-ecule, the complete mol-ecule being generated by crystallographic inversion symmetry. Both thio-urea moieties are in a trans conformation. An intra-molecular N-H⋯O hydrogen bond occurs. In the crystal, C-H⋯S and C-H⋯O hydrogen bonds link the molecules, forming layers parallel to the ac plane.

12.
Acta Crystallogr E Crystallogr Commun ; 74(Pt 12): 1862-1866, 2018 Dec 01.
Artigo em Inglês | MEDLINE | ID: mdl-30574389

RESUMO

In the penta-nuclear title complex, [SmZn2(C22H18N2O4)2(NCS)2(C3H7NO)2][Zn2(C22H18N2O4)(NCS)3]·C3H7NO·0.32H2O, namely bis-{µ2-6,6'-dimeth-oxy-2,2'-[phenyl-ene-1,2-diylbis(nitrilo-methanylyl-idene)]diphenolato}-1κ4 O,N,N',O':2κ3 O,O',O 6;2κ3 O,O',O 6:3κ4 O,N,N',O'-bis-(di-methyl-formamide-2κO)di-thiocyanato-1κN,3κN-2-samarium(III)-1,3-dizinc(II) {µ2-6,6'-dimeth-oxy-2,2'-[phenyl-ene-1,2-diylbis(nitrilo-methanylyl-idene)]diphenolato-1κ4 O,N,N',O':2κ2 O,O'}trithio-cyan-ato-1κN;2κ2 N,N-dizinc(II) di-methyl-formamide monosolvate 1.32-hydrate, a dinuclear unit and a trinuclear unit co-exist. One of the ZnII centers in the dinuclear unit as well as the two ZnII centers in the trinuclear unit are located in the inner N2O2 cavity of the ligand and are coordinated to the nitro-gen atom of one thio-cyanate moiety, giving rise to a square-pyramidal geometry. The second ZnII center in the dinuclear unit is coordinated to the two phenolate oxygen atoms of the ligand and to two thio-cyanate groups via the nitro-gen atom in a tetra-hedral geometry. The SmIII ion is eight-coordinated by four phenolate O atoms from the two ligand mol-ecules, two meth-oxy O atoms from the two ligand mol-ecules and two O atoms from the DFM solvent mol-ecule. In the dinuclear unit, the two meth-oxy oxygen atoms remain uncoordinated while in the trinuclear unit, for each ligand one meth-oxy oxygen is coordinated and the other one remains uncoordinated. In the crystal, the trinuclear cationic units and dinuclear anionic units are assembled into infinite layers. These layers are held together via electrostatic inter-actions, forming a three-dimensional structure. In the dinuclear unit, the C and S atoms of one of the thio-cyanate groups are disordered over two sets of sites in a 0.680 (4)(4):0.320 (4) ratio.

13.
Acta Crystallogr E Crystallogr Commun ; 74(Pt 6): 799-802, 2018 Jun 01.
Artigo em Inglês | MEDLINE | ID: mdl-29951233

RESUMO

The binuclear complex, [Sn2(C4H9)4(C16H10N4O4)], contains two Sn4+ ions, connected by doubly N-deprotonated oxalylbis[(2-oxido-benzyl-idene)hydrazide] ligands, and each Sn4+ ion is linked to two tert-butyl groups. The coordination sphere of each Sn atom is best described as a distorted trigonal bipyramid. Each stannic ion in the complex is in a C2O2N environment. The two homologous parts of the doubly deprotonated ligand are located in trans positions with respect to the C-C bond of the oxalamide group. The oxalamide group exhibits an asymmetric coordination geometry, as seen by the slight difference between the C-O and C-N bond lengths. The three-dimensional network is a multilayer of complex mol-ecules with no strong supramolecular inter-actions.

14.
Acta Crystallogr E Crystallogr Commun ; 74(Pt 4): 450-453, 2018 Apr 01.
Artigo em Inglês | MEDLINE | ID: mdl-29765743

RESUMO

The search for novel manganese(II) compounds having inter-esting magnetic properties, using 1-(pyridin-2-yl)-2-(pyridin-2-yl-methyl-idene)hydrazine (HL) as a tridendate ligand, led to the preparation of the title mononuclear material, [MnCl(NO3)(C11H10N4)(H2O)], and the determination of its structure by XRD. The asymmetric unit comprises a discrete mol-ecule in which the cation MnII is hepta-coordinated. The environment around the cation is an almost perfect penta-gonal bipyramid. The base is defined by the two N atoms of the pyridine rings, the N atom of the imino function of the ligand and the two O atoms of the chelating bidentate nitrate ligand. The apical positions are occupied by a Cl atom and a water mol-ecule. In the crystal, there are numerous hydrogen bonds of the types Ow-H⋯ONO2 and C-H⋯ONO2, which generate layers parallel to the bc plane in which the ligands in the axial positions point into the inter-layer space. These axial ligands give rise to hydrogen bonds of the types Ow-H⋯ONO2, Ow-H⋯Cl, N-H⋯Cl and C-H⋯Cl, leading to a three-dimensional framework. The chain bridging the two pyridine rings is disordered over two sets of sites in a 0.53 (2):0.47 (2) ratio.

15.
Acta Crystallogr E Crystallogr Commun ; 73(Pt 8): 1121-1124, 2017 Jul 01.
Artigo em Inglês | MEDLINE | ID: mdl-28932419

RESUMO

In the title compound, [Tb(C2H3O2)2(C11H10N4)(H2O)2]NO3·H2O, the Tb3+ ion is nine-coordinated in a distorted tricapped trigonal-prismatic geometry by the three N atoms of the tridentate 1-(pyridin-2-yl-methyl-idene)-2-(pyridin-2-yl)hydrazine ligand, four carboxyl-ate O atoms of two chelating acetate groups and two O atoms of the coordinating water mol-ecules. The organic hydrazine ligand is disordered over two orientations with a refined occupancy ratio of 0.52 (3):0.48 (3). All bond lengths in the coordination environment of the Tb3+ ion are slightly larger than those observed in the isostructural Y3+ and Er3+ complexes. In the crystal, the complex cations are linked by pairs of O-H⋯O hydrogen bonds into dimers. These dimers, nitrate anions and non-coordinating water mol-ecules are joined by O-H⋯O and N-H⋯O hydrogen bonds into a three-dimensional structure.

16.
Acta Crystallogr E Crystallogr Commun ; 73(Pt 2): 115-117, 2017 Feb 01.
Artigo em Inglês | MEDLINE | ID: mdl-28217323

RESUMO

The title compound, C21H36O3, contains an oxolane ring, and six defined stereocentres and may serve as a useful synthon for the synthesis of calcitriol analogues. The configurations of the chiral C atoms of the side chain were unambiguously established in the refinement. In the crystal, C-H⋯O and extremely weak O-H⋯O hydrogen bonds arising from the sterically hindered alcohol group link the mol-ecules into a three-dimensional network.

17.
Acta Crystallogr Sect E Struct Rep Online ; 70(Pt 4): o423, 2014 Apr 01.
Artigo em Inglês | MEDLINE | ID: mdl-24826134

RESUMO

In the title compound, C17H18N4O5·0.47CH3OH, the virtually planar (r.m.s. deviation = 0.128 Å) carbonohydrazide mol-ecule is located on a twofold axis and conformation of its C=N bonds is E. There are short intra-molecular O-H⋯N hydrogen bonds between the hy-droxy groups and hydrazide N atoms. In the crystal, bifurcated N-H⋯(O,O) hydrogen bonds assemble the carbonohydrazide mol-ecules into a three-dimensional network. There are C 2 symmetric voids in this network, 47% of which are occupied by disordered methanol mol-ecules.

18.
Acta Crystallogr Sect E Struct Rep Online ; 69(Pt 1): m24-5, 2013 Jan 01.
Artigo em Inglês | MEDLINE | ID: mdl-23476324

RESUMO

The title complex, [Cu(SO4)(C13H13N3)(H2O)]·4H2O, was obtained by mixing copper sulfate penta-hydrate and 2-(pyridin-2-yl)-N-(pyridin-2-yl-methyl-idene)ethanamine in eth-anol under reflux conditions. The Cu(II) ion shows a Jahn-Teller-distorted octa-hedral geometry, with equatorial positions occupied by three N atoms from the tridentate ligand (average Cu-N = 2.004 Å) and one O atom from a bidentate sulfate anion [Cu-O = 1.963 (2) Å]. The axial positions are occupied by one O atom from a coordinating water mol-ecule [Cu-O = 2.230 (3) Å] and one weakly bonded O atom [Cu-O = 2.750 (2) Å] from the bidentate sulfate ion. The complex mol-ecules are connected through O-H⋯O hydrogen bonds between the coordinating water mol-ecules and sulfate ions from neighboring complexes, forming a double chain parallel to the c axis. The chains are stabilized through additional hydrogen bonds by one of the non-coordinating water mol-ecules bridging between neighboring strands of the double chains. The remaining three water mol-ecules fill the inter-stitial space between the double chains and are involved in an intricate hydrogen-bonding network that consolidates the structure.

19.
Acta Crystallogr Sect E Struct Rep Online ; 69(Pt 2): m108, 2013 Feb 01.
Artigo em Inglês | MEDLINE | ID: mdl-23424404

RESUMO

The title compound, [ZnCl(2)(C(18)H(14)N(4)O)], crystallizes with two mol-ecules in the asymmetric unit, which differ in the tautomeric (neutral and zwitterionic) forms of the coordin-ating organic ligand. In both mol-ecules, the Zn(II) atom adopts a distorted square-pyramidal geometry by two N and one O atoms of the Schiff base ligand and two Cl atoms acting as monodentate chloride anions. The crystal packing is stabilized by N-H⋯N and N-H⋯Cl hydrogen bonds, forming a two-dimensional network parallel to the ac plane.

20.
Acta Crystallogr Sect E Struct Rep Online ; 68(Pt 10): m1250, 2012 Oct 01.
Artigo em Inglês | MEDLINE | ID: mdl-23125583

RESUMO

In the title complex, [MnCl(2)(C(13)H(13)N(3))]·H(2)O, the Mn(II) atom is in a distorted square-pyramidal environment, with an Addison τ parameter of 0.037. The coordination geometry is defined by three N-atom donors from the tridentate 2-(pyridin-2-yl)-N-(pyridin-2-yl-methyl-idene)ethanamine ligand and two terminal Cl atoms. Although the H atoms of the lattice water molecule were not located, O⋯O distances of 3.103 (7) Šand O⋯Cl distances of 3.240 (3) and 3.482 (4) Šsuggest that hydrogen bonding is responsible for the stabilization of the crystal packing.

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