Molecular structure of 1,2-dimethyl-1,2-diazetidine. Electron diffraction and microwave study and normal coordinate analysis

Journal of the Chemical Society Faraday Transactions 2 Molecular and Chemical Physics ◽

10.1039/f29807601293 ◽

1980 ◽

Vol 76 ◽

pp. 1293 ◽

Author(s):

Karl F. Gebhardt ◽

Heinz Oberhammer ◽

Werner Zeil

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Normal Coordinate Analysis ◽

Normal Coordinate

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ChemInform Abstract: VIBRATIONAL SPECTRA AND NORMAL COORDINATE ANALYSIS OF TRIFLUOROMETHYL COMPOUNDS. PART XXVII. PERFLUOROTRIMETHYLAMINE. REINVESTIGATION OF THE MOLECULAR STRUCTURE BY ELECTRON DIFFRACTION

Chemischer Informationsdienst ◽

10.1002/chin.197943043 ◽

1979 ◽

Vol 10 (43) ◽

Author(s):

H. BUERGER ◽

H. NIEPEL ◽

G. PAWELKE ◽

H. OBERHAMMER

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Vibrational Spectra ◽

Normal Coordinate Analysis ◽

Normal Coordinate

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Molecular structure, Normal Coordinate Analysis, harmonic vibrational frequencies, Natural Bond Orbital, TD-DFT calculations and biological activity analysis of antioxidant drug 7-hydroxycoumarin

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2012.09.041 ◽

2013 ◽

Vol 101 ◽

pp. 370-381 ◽

Author(s):

S. Sebastian ◽

S. Sylvestre ◽

D. Jayarajan ◽

M. Amalanathan ◽

K. Oudayakumar ◽

...

Keyword(s):

Molecular Structure ◽

Biological Activity ◽

Dft Calculations ◽

Natural Bond Orbital ◽

Activity Analysis ◽

Vibrational Frequencies ◽

Normal Coordinate Analysis ◽

Normal Coordinate ◽

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Study of vibrational spectra, normal coordinate analysis and molecular structure of 6-(2,3-dichlorophenyl)-1,2,4-triazine-3,5-diamine using density functional theory

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2013.10.120 ◽

2014 ◽

Vol 121 ◽

pp. 420-429 ◽

Author(s):

S. Muthu ◽

A. Prabakaran

Keyword(s):

Molecular Structure ◽

Density Functional Theory ◽

Vibrational Spectra ◽

Density Functional ◽

Normal Coordinate Analysis ◽

Normal Coordinate ◽

Functional Theory

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Gas-Phase Molecular Structure of Corannulene, C20H10. An Electron-Diffraction Study Augmented by ab Initio and Normal Coordinate Calculations

The Journal of Physical Chemistry A ◽

10.1021/jp0015527 ◽

2000 ◽

Vol 104 (32) ◽

pp. 7689-7694 ◽

Author(s):

Lise Hedberg ◽

Kenneth Hedberg ◽

Pei-chao Cheng ◽

Lawrence T. Scott

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio ◽

Diffraction Study ◽

Gas Phase ◽

Electron Diffraction Study ◽

Normal Coordinate

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Molecular structure, vibrational spectra and normal coordinate analysis of S-methyl dithiocarbamate

Journal of Molecular Structure ◽

10.1016/0022-2860(83)90163-1 ◽

1983 ◽

Vol 99 (1-2) ◽

pp. 119-132 ◽

Author(s):

R. Mattes ◽

Lin Zhengyan ◽

M. Thünemann ◽

H. Schnöckel

Keyword(s):

Molecular Structure ◽

Vibrational Spectra ◽

Normal Coordinate Analysis ◽

Normal Coordinate

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ChemInform Abstract: VIBRATIONAL SPECTRA AND NORMAL-COORDINATE ANALYSIS OF TRIFLUOROMETHYL COMPOUNDS. 17. CRYSTAL AND MOLECULAR STRUCTURE, REINVESTIGATED VIBRATIONAL SPECTRA, AND NORMAL-COORDINATE ANALYSIS OF POTASSIUM (TRIFLUOROMETHYL)TRIFLUOROBORATE, K(

Chemischer Informationsdienst ◽

10.1002/chin.197749088 ◽

1977 ◽

Vol 8 (49) ◽

pp. no-no

Author(s):

D. J. BRAUER ◽

H. BUERGER ◽

G. PAWELKE

Keyword(s):

Molecular Structure ◽

Vibrational Spectra ◽

Crystal And Molecular Structure ◽

Normal Coordinate Analysis ◽

Normal Coordinate

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ChemInform Abstract: VIBRATIONAL SPECTRA AND NORMAL COORDINATE ANALYSIS OF TRIFLUOROMETHYL COMPOUNDS. 37. MOLECULAR STRUCTURE, VIBRATIONAL SPECTRA, AND NORMAL COORDINATE ANALYSIS OF THE PERFLUOROMETHYLAMINES CF3NF2 AND (CF3)2NF

Chemischer Informationsdienst ◽

10.1002/chin.198224069 ◽

1982 ◽

Vol 13 (24) ◽

Author(s):

H. OBERHAMMER ◽

H. GUENTHER ◽

H. BUERGER ◽

F. HEYDER ◽

G. PAWELKE

Keyword(s):

Molecular Structure ◽

Vibrational Spectra ◽

Normal Coordinate Analysis ◽

Normal Coordinate

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The gas-phase structure of azetidine: Microwave spectroscopy, and electron diffraction and normal coordinate analysis

Journal of Molecular Spectroscopy ◽

10.1016/0022-2852(84)90251-0 ◽

1984 ◽

Vol 104 (1) ◽

pp. 152-164 ◽

Author(s):

Horst Günther ◽

Gisela Schrem ◽

Heinz Oberhammer

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Phase Structure ◽

Microwave Spectroscopy ◽

Normal Coordinate Analysis ◽

Normal Coordinate ◽

Gas Phase Structure

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Molecular structure, normal coordinate analysis, harmonic vibrational frequencies, NBO, HOMO–LUMO analysis and detonation properties of (S)-2-(2-oxopyrrolidin-1-yl) butanamide by density functional methods

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2013.09.055 ◽

2014 ◽

Vol 118 ◽

pp. 702-715 ◽

Author(s):

S. Renuga ◽

S. Muthu

Keyword(s):

Molecular Structure ◽

Density Functional ◽

Vibrational Frequencies ◽

Normal Coordinate Analysis ◽

Detonation Properties ◽

Normal Coordinate ◽

Density Functional Methods ◽

Functional Methods ◽

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Conformational Structure of Gaseous 3-Chloropropanoyl Chloride by Electron Diffraction, Normal Coordinate Analysis, and ab Initio Molecular Orbital, and Density Functional Theory Calculations

The Journal of Physical Chemistry A ◽

10.1021/jp064187d ◽

2006 ◽

Vol 110 (38) ◽

pp. 11136-11144 ◽

Author(s):

Tore H. Johansen ◽

Kolbjørn Hagen

Keyword(s):

Density Functional Theory ◽

Electron Diffraction ◽

Ab Initio ◽

Molecular Orbital ◽

Density Functional ◽

Density Functional Theory Calculations ◽

Normal Coordinate Analysis ◽

Conformational Structure ◽

Normal Coordinate ◽

Functional Theory

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