187 related articles for article (PubMed ID: 25306134)
21. Experimental (FT-IR, FT-Raman, UV and NMR) and quantum chemical studies on molecular structure, spectroscopic analysis, NLO, NBO and reactivity descriptors of 3,5-Difluoroaniline.
Pathak SK; Srivastava R; Sachan AK; Prasad O; Sinha L; Asiri AM; Karabacak M
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 135():283-95. PubMed ID: 25078461
[TBL] [Abstract][Full Text] [Related]
22. DFT calculations and experimental FT-IR, FT-Raman, NMR, UV-Vis spectral studies of 3-fluorophenylboronic acid.
Karabacak M; Kose E; Sas EB; Kurt M; Asiri AM; Atac A
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():306-20. PubMed ID: 25448934
[TBL] [Abstract][Full Text] [Related]
23. Importance of weak interactions in developing 1,3-bis(4,6-dimethyl-1H-nicotinonitrile-1-yl)1,3-dioxy propane polymorphs.
Tewari AK; Singh VP; Dubey R; Puerta C; Valerga P; Verma R
Spectrochim Acta A Mol Biomol Spectrosc; 2011 Sep; 79(5):1267-75. PubMed ID: 21664173
[TBL] [Abstract][Full Text] [Related]
24. Molecular structural, IR and NMR spectroscopic studies on the four isomers of thiotriazinone by DFT and HF calculations.
Wang S; He Q; Wang J; Qu Y
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 87():179-89. PubMed ID: 22154268
[TBL] [Abstract][Full Text] [Related]
25. Experimental and theoretical investigations of 4-chloro-N-(2-methoxyphenyl)benzamidoxime.
Kara YS; Sagdinc SG; Karadayı N
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Jun; 110():351-63. PubMed ID: 23583853
[TBL] [Abstract][Full Text] [Related]
26. Synthesis, structural and vibrational investigation on 2-phenyl-N-(pyrazin-2-yl)acetamide combining XRD diffraction, FT-IR and NMR spectroscopies with DFT calculations.
Lukose J; Yohannan Panicker C; Nayak PS; Narayana B; Sarojini BK; Van Alsenoy C; Al-Saadi AA
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 135():608-16. PubMed ID: 25124846
[TBL] [Abstract][Full Text] [Related]
27. Synthesis, crystal structure and theoretical studies of a Schiff base 2-[4-hydroxy benzylidene]-amino naphthalene.
Arunagiri C; Subashini A; Saranya M; Thomas Muthiah P; Thanigaimani K; Abdul Razak I
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Jan; 135():307-16. PubMed ID: 25084236
[TBL] [Abstract][Full Text] [Related]
28. An experimental and theoretical study on the novel (Z)-1-((naphthalen-2-ylamino)methylene)naphthalen-2(1H)-one crystal.
Tamer Ö; Dege N; Demirtaş G; Avcı D; Atalay Y; Macit M; Ağar AA
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Jan; 117():13-23. PubMed ID: 23978793
[TBL] [Abstract][Full Text] [Related]
29. FT-IR, FT-Raman, NMR studies and ab initio-HF, DFT-B3LYP vibrational analysis of 4-chloro-2-fluoroaniline.
Arivazhagan M; Anitha Rexalin D
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():668-76. PubMed ID: 22885079
[TBL] [Abstract][Full Text] [Related]
30. Synthesis, X-ray structural, characterization, NBO and HOMO-LUMO analysis using DFT study of 4-methyl-N-(naphthalene-1-yl)benzene sulfonamide.
Sarojini K; Krishnan H; Kanakam CC; Muthu S
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Oct; 96():657-67. PubMed ID: 22871549
[TBL] [Abstract][Full Text] [Related]
31. X-ray crystallography characterization, vibrational spectroscopy, NMR spectra and quantum chemical DFT/HF study of N,N'-di(2-methoxyphenyl)formamidine.
Rofouei MK; Sohrabi N; Shamsipur M; Fereyduni E; Ayyappan S; Sundaraganesan N
Spectrochim Acta A Mol Biomol Spectrosc; 2010 Jul; 76(2):182-90. PubMed ID: 20409749
[TBL] [Abstract][Full Text] [Related]
32. Molecular structure, spectroscopic properties, NLO, HOMO-LUMO and NBO analyses of 6-hydroxy-3(2H)-pyridazinone.
Soliman SM; Albering J; Abu-Youssef MA
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Feb; 136 Pt B():1086-98. PubMed ID: 25459506
[TBL] [Abstract][Full Text] [Related]
33. Synthesis, crystal structure, vibrational spectroscopy, optical properties and theoretical studies of a new organic-inorganic hybrid material: [((CH3)2NH2)(+)]6·[(BiBr6)(3-)]2.
Ben Ahmed A; Feki H; Abid Y
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Dec; 133():357-64. PubMed ID: 24967541
[TBL] [Abstract][Full Text] [Related]
34. FT-IR, FT-Raman and UV spectroscopic investigation, electronic properties, electric moments, and NBO analysis of anethole using quantum chemical calculations.
Sinha L; Prasad O; Chand S; Sachan AK; Pathak SK; Shukla VK; Karabacak M; Asiri AM
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Dec; 133():165-77. PubMed ID: 24934975
[TBL] [Abstract][Full Text] [Related]
35. Structural, vibrational and DSC investigations of the bis-4-benzyl piperidinium tetraoxoselenate monohydrate crystal.
Kessentini Y; Ben Ahmed A; Elaoud Z; Aljuaid SS; Mhiri T
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Dec; 98():222-8. PubMed ID: 22964243
[TBL] [Abstract][Full Text] [Related]
36. Concomitant polymorphism of a pyridine-2,6-dicarboxamide derivative in a single space group: experimental and molecular modeling study.
Özdemir N; Dayan O; Çetinkaya B; Akgül C
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 86():614-24. PubMed ID: 22137748
[TBL] [Abstract][Full Text] [Related]
37. Molecular structure of 2-chloromethyl-1H-benzimidazole hydrochloride: single crystal, spectral, biological studies, and DFT calculations.
Abdel Ghani NT; Mansour AM
Spectrochim Acta A Mol Biomol Spectrosc; 2012 Feb; 86():605-13. PubMed ID: 22153740
[TBL] [Abstract][Full Text] [Related]
38. 3-Phenylpyridinium hydrogen squarate: experimental and computational study of a nonlinear optical material.
Korkmaz U; Bulut A; Bulut İ
Spectrochim Acta A Mol Biomol Spectrosc; 2015 Apr; 140():140-9. PubMed ID: 25590828
[TBL] [Abstract][Full Text] [Related]
39. Growth, molecular structure, NBO analysis and vibrational spectral analysis of l-tartaric acid single crystal.
Sasikala V; Sajan D; Vijayan N; Chaitanya K; Babu Raj MS; Selin Joy BH
Spectrochim Acta A Mol Biomol Spectrosc; 2014 Apr; 123():127-41. PubMed ID: 24394529
[TBL] [Abstract][Full Text] [Related]
40. Synthesis, molecular structure, hydrogen-bonding, NBO and chemical reactivity analysis of a novel 1,9-bis(2-cyano-2-ethoxycarbonylvinyl)-5-(4-hydroxyphenyl)-dipyrromethane: a combined experimental and theoretical (DFT and QTAIM) approach.
Singh RN; Kumar A; Tiwari RK; Rawat P
Spectrochim Acta A Mol Biomol Spectrosc; 2013 Sep; 113():378-85. PubMed ID: 23747377
[TBL] [Abstract][Full Text] [Related]
[Previous] [Next] [New Search]