Detalhe da pesquisa
1.
2,4,6-Tri-amino-1,3,5-triazin-1-ium 3-(prop-2-eno-yloxy)propano-ate acrylic acid monosolvate monohydrate.
Acta Crystallogr Sect E Struct Rep Online
; 69(Pt 5): o741, 2013 May 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-23723892
2.
3-Nitro-phenol-1,3,5-triazine-2,4,6-tri-amine (2/1).
Acta Crystallogr Sect E Struct Rep Online
; 69(Pt 6): o827, 2013 Jun 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-23795017
3.
Quantum computational investigation into structural, spectroscopic, topological and electronic properties of L-histidinium-L-tartrate hemihydrate: Nonlinear optical organic single crystal.
Heliyon
; 9(4): e14879, 2023 Apr.
Artigo
em Inglês
| MEDLINE | ID: mdl-37025852
4.
4-Nitro-phenol-2,4,6-triamino-1,3,5-triazine-water (2/1/1).
Acta Crystallogr Sect E Struct Rep Online
; 68(Pt 7): o2286, 2012 Jul 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-22798930
5.
DFT, hirshfeld and molecular docking studies of a hybrid compound - 2,4-Diamino-6-methyl-1,3,5-triazin-1-ium hydrogen oxalate as a promising anti -breast cancer agent.
Heliyon
; 8(8): e10355, 2022 Aug.
Artigo
em Inglês
| MEDLINE | ID: mdl-36061020
6.
Crystal structure and vibrational spectra of piperazinium bis(4-hydroxybenzenesulphonate) molecular-ionic crystal.
Spectrochim Acta A Mol Biomol Spectrosc
; 69(2): 312-8, 2008 Feb.
Artigo
em Inglês
| MEDLINE | ID: mdl-17627870
7.
The theoretical and experimental vibrational studies of thiourea and silver nitrate (2:1) complex.
Spectrochim Acta A Mol Biomol Spectrosc
; 204: 717-725, 2018 Nov 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-29986318
8.
The structure, vibrational spectra and nonlinear optical properties of the L-lysine x tartaric acid complex--theoretical studies.
Spectrochim Acta A Mol Biomol Spectrosc
; 64(1): 6-23, 2006 May 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-16384740
9.
Structural and vibrational spectral investigations of melaminium glutarate monohydrate by FTIR, FT-Raman and DFT methods.
Spectrochim Acta A Mol Biomol Spectrosc
; 135: 540-50, 2015 Jan 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-25123944
10.
Synthesis, characterization and theoretical studies of 5-(benzylthio)-1-cylopentyl-1H-tetrazole.
Spectrochim Acta A Mol Biomol Spectrosc
; 135: 1011-8, 2015 Jan 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-25171051
11.
Evans hole and non linear optical activity in Bis(melaminium) sulphate dihydrate: A vibrational spectral study.
Spectrochim Acta A Mol Biomol Spectrosc
; 151: 292-301, 2015.
Artigo
em Inglês
| MEDLINE | ID: mdl-26143321
12.
Structural and vibrational spectroscopic studies on charge transfer and ionic hydrogen bonding interactions of melaminium benzoate dihydrate.
Spectrochim Acta A Mol Biomol Spectrosc
; 145: 394-409, 2015 Jun 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-25796010
13.
Comparative study of vibrational spectra of Rb4LiH3(SO4)4, K4LiH3(SO4)4, K4LiH3(SeO4)4, Na5H3(SeO4)4.2H2O and Na2SeO4.H2SeO3.H2O crystals. Polarized infrared and Raman studies.
Spectrochim Acta A Mol Biomol Spectrosc
; 60(1-2): 201-10, 2004 Jan.
Artigo
em Inglês
| MEDLINE | ID: mdl-14670479
14.
Comprehensive quantum chemical and spectroscopic (FTIR, FT-Raman, 1H, 13C NMR) investigations of O-desmethyltramadol hydrochloride an active metabolite in tramadol--an analgesic drug.
Spectrochim Acta A Mol Biomol Spectrosc
; 122: 315-30, 2014 Mar 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-24316546
15.
Structural, vibrational and theoretical studies of anilinium trichloroacetate: new hydrogen bonded molecular crystal with nonlinear optical properties.
Spectrochim Acta A Mol Biomol Spectrosc
; 118: 82-93, 2014 Jan 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-24041532
16.
Vibrational, DFT, thermal and dielectric studies on 3-nitrophenol-1,3,5-triazine-2,4,6-triamine (2/1).
Spectrochim Acta A Mol Biomol Spectrosc
; 118: 1025-37, 2014 Jan 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-24161865
17.
Structure and vibrational spectra of melaminium bis(trifluoroacetate) trihydrate: FT-IR, FT-Raman and quantum chemical calculations.
Spectrochim Acta A Mol Biomol Spectrosc
; 125: 252-63, 2014 May 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-24556134
18.
The 'partial resonance' of the ring in the NLO crystal melaminium formate: study using vibrational spectra, DFT, HOMO-LUMO and MESP mapping.
Spectrochim Acta A Mol Biomol Spectrosc
; 104: 97-109, 2013 Mar.
Artigo
em Inglês
| MEDLINE | ID: mdl-23266682
19.
FTIR, FT-Raman, FT-NMR and quantum chemical investigations of 3-acetylcoumarin.
Spectrochim Acta A Mol Biomol Spectrosc
; 109: 79-89, 2013 May 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-23501720
20.
Structural and vibrational spectral investigations of melaminium maleate monohydrate by FTIR, FT-Raman and quantum chemical calculations.
Spectrochim Acta A Mol Biomol Spectrosc
; 107: 90-101, 2013 Apr 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-23416913