X-ray, vibrational spectra and quantum chemical studies on a new semiorganic crystal: 4-Chloroanilinium perchlorate

Journal of Molecular Structure ◽

10.1016/j.molstruc.2014.07.035 ◽

2014 ◽

Vol 1076 ◽

pp. 115-125 ◽

Cited By ~ 14

Author(s):

R. Anitha ◽

S. Athimoolam ◽

M. Gunasekaran ◽

K. Anitha

Keyword(s):

Vibrational Spectra ◽

Quantum Chemical ◽

X Ray ◽

Chemical Studies ◽

Quantum Chemical Studies

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A strong NH…Br vibrational behaviour studied through X-ray, vibrational spectra and quantum chemical studies in an isomorphous crystal: 2-Nitroanilinium bromide

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2014.11.077 ◽

2015 ◽

Vol 138 ◽

pp. 753-762 ◽

Cited By ~ 8

Author(s):

R. Anitha ◽

S. Athimoolam ◽

M. Gunasekaran

Keyword(s):

Vibrational Spectra ◽

Quantum Chemical ◽

X Ray ◽

Chemical Studies ◽

Quantum Chemical Studies

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QUANTUM CHEMICAL STUDIES ON THE PREDICTION OF STRUCTURES, CHARGE DISTRIBUTIONS AND VIBRATIONAL SPECTRA OF SOME Ni(II), Zn(II), AND Cd(II) IODIDE COMPLEXES

Proceedings of the 71st International Symposium on Molecular Spectroscopy ◽

10.15278/isms.2016.mi15 ◽

2016 ◽

Author(s):

Tayyibe Bardakci ◽

Ahmet Altun ◽

Mustafa Kumru

Keyword(s):

Vibrational Spectra ◽

Quantum Chemical ◽

Charge Distributions ◽

Chemical Studies ◽

Quantum Chemical Studies

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XRD, vibrational spectra and quantum chemical studies of an anticancer drug: 6-Mercaptopurine

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2015.02.104 ◽

2015 ◽

Vol 146 ◽

pp. 204-213 ◽

Cited By ~ 15

Author(s):

S. Suresh Kumar ◽

S. Athimoolam ◽

B. Sridhar

Keyword(s):

Anticancer Drug ◽

Vibrational Spectra ◽

Quantum Chemical ◽

Chemical Studies ◽

Quantum Chemical Studies

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Solution- and Solid-State Coordination Behavior of ω-Trichlorostannyl Alcohols, HO(CH2)nSnCl3(n= 3−5): X-ray Diffraction, Multinuclear NMR, and AM1 Quantum Chemical Studies

Organometallics ◽

10.1021/om970449+ ◽

1998 ◽

Vol 17 (1) ◽

pp. 90-97 ◽

Cited By ~ 22

Author(s):

Monique Biesemans ◽

Rudolph Willem ◽

Said Damoun ◽

Paul Geerlings ◽

Edward R. T. Tiekink ◽

...

Keyword(s):

Solid State ◽

Quantum Chemical ◽

X Ray Diffraction ◽

X Ray ◽

Multinuclear Nmr ◽

Coordination Behavior ◽

Chemical Studies ◽

Quantum Chemical Studies ◽

State Coordination

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Scaled Quantum Chemical Studies of the Molecular Structure and Vibrational Spectra of Minoxidil

Spectroscopy Letters ◽

10.1080/00387010.2014.880066 ◽

2014 ◽

Vol 48 (1) ◽

pp. 63-73 ◽

Cited By ~ 3

Author(s):

Sambantham Muthu ◽

Arunachalam Prabakaran

Keyword(s):

Molecular Structure ◽

Vibrational Spectra ◽

Quantum Chemical ◽

Chemical Studies ◽

Quantum Chemical Studies

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Molecular determinants for drug–receptor interactions. Part 13. X-Ray molecular structure of naltrexone malonate and quantum chemical studies of the conformations of the pure narcotic antagonists naloxone and naltrexone

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29900001757 ◽

1990 ◽

pp. 1757-1762 ◽

Cited By ~ 6

Author(s):

Maria E. Amato ◽

Giuliano Bandoli ◽

Antonio Grassi ◽

Marino Nicolini ◽

Giuseppe C. Pappalardo

Keyword(s):

Molecular Structure ◽

Quantum Chemical ◽

X Ray ◽

Narcotic Antagonists ◽

Molecular Determinants ◽

Receptor Interactions ◽

Chemical Studies ◽

Quantum Chemical Studies ◽

Drug Receptor

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ChemInform Abstract: Synthetic, Spectroscopic, X-Ray Structural, and Quantum-Chemical Studies of Cyanothiomolybdates with Mo2S, Mo2S2, Mo3S4, and Mo4S4 Cores: A Remarkable Class of Species Existing with Different Electron Populations and Having the Same C

Chemischer Informationsdienst ◽

10.1002/chin.198551262 ◽

1985 ◽

Vol 16 (51) ◽

Author(s):

A. MUELLER ◽

R. JOSTES ◽

W. ELTZNER ◽

C.-S. NIE ◽

E. DIEMANN ◽

...

Keyword(s):

Quantum Chemical ◽

X Ray ◽

Chemical Studies ◽

Quantum Chemical Studies

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Quantum Chemical Studies on Heterocyclic Rearrangements in Benzofuroxans: Reaction Paths, Vibrational Spectra, and Rate Constants

High Performance Computing in Science and Engineering ’99 ◽

10.1007/978-3-642-59686-5_16 ◽

2000 ◽

pp. 183-193

Author(s):

Guntram Rauhut ◽

Frank Eckert

Keyword(s):

Vibrational Spectra ◽

Rate Constants ◽

Quantum Chemical ◽

Reaction Paths ◽

Chemical Studies ◽

Quantum Chemical Studies

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Experimental and quantum chemical studies of structure and vibrational spectra of platinum(II) and palladium(II) thiourea chlorides

Journal of Molecular Structure ◽

10.1016/j.molstruc.2005.01.008 ◽

2005 ◽

Vol 740 (1-3) ◽

pp. 229-235 ◽

Cited By ~ 18

Author(s):

L. Fuks ◽

N. Sadlej-Sosnowska ◽

K. Samochocka ◽

W. Starosta

Keyword(s):

Vibrational Spectra ◽

Quantum Chemical ◽

Chemical Studies ◽

Quantum Chemical Studies

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Molecular structure of trimethylphosphine–gallane, Me3P·GaH3: gas-phase electron diffraction, single-crystal X-ray diffraction, and quantum chemical studies

Dalton Transactions ◽

10.1039/b306736j ◽

2003 ◽

pp. 3526-3533 ◽

Cited By ~ 12

Author(s):

Christina Y. Tang ◽

Robert A. Coxall ◽

Anthony J. Downs ◽

Tim M. Greene ◽

Lorna Kettle ◽

...

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Single Crystal ◽

Gas Phase ◽

Quantum Chemical ◽

X Ray Diffraction ◽

X Ray ◽

Chemical Studies ◽

Quantum Chemical Studies ◽

Gas Phase Electron Diffraction

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