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Intramolecular Motions in 1,2,3-Triethyldiaziridine: A Quantum Chemistry Study

Russian Journal of Physical Chemistry A, 2020-09, Vol.94 (9), p.1836-1842

2020

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The Equilibrium Molecular Structure of 4-Cyanopyridine According to a Combined Analysis of Gas-Phase Electron Diffraction and Microwave Data and Coupled-Cluster Computations

Russian Journal of Physical Chemistry A, 2018-10, Vol.92 (10), p.1970-1974

2018

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Electron diffraction study of the equilibrium structure of hexamethylenetetramine involving data from quantum chemistry and vibrational spectroscopy

Russian Journal of Physical Chemistry A, 2014-04, Vol.88 (4), p.652-656

2014

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Structure, spectra and internal rotation of bis(trimethylsilyl) acetylene: spectral analysis by scaling quantum-chemical force fields and two methods for calculating vibrational effects

Journal of molecular structure, 2000-05, Vol.523 (1-3), p.1-22

2000

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Analysis of electron diffraction data for several symmetric coordinates of large-amplitude motions in the case of the 1,3,5-trinitrobenzene molecule

Russian Journal of Physical Chemistry A, 2015-06, Vol.89 (6), p.1033-1040

2015

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Internal Rotation in Tolane: Molecular Structure in Gas and Crystal Phases

Acta chemica Scandinavica (Copenhagen. 1989), 1988, Vol.42a, p.674-684

1988

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The structure and spectra of 1,1-bis(trimethylsilylethynyl)-cyclopropane: a priori calculated force field and vibrational effects

Journal of molecular structure, 2002-10, Vol.641 (1), p.41-60

2002

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The structure and spectra of 1-silylpropyne: scaled quantum-chemical force fields and vibrational effects

Journal of molecular structure, 2001-06, Vol.567-568, p.85-99

2001

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Structure, spectra, and intramolecular motions of 1,4-bis(trimethylsilyl)-1,3-butadiyne: an electron diffraction study using the results of spectral analysis based on scaled quantum-chemical force field for calculating vibrational effects

Journal of molecular structure, 2001-01, Vol.559 (1-3), p.295-313

2001

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Quantum-chemical calculations and electron diffraction study of the equilibrium molecular structure of vitamin K3

Russian Journal of Physical Chemistry A, 2014, Vol.88 (5), p.886-889

2014

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The structure of nitrobenzene and the interpretation of the vibrational frequencies of the C-NO2 moiety on the basis of ab initio calculations

Journal of molecular structure, 1994-09, Vol.326, p.1-16

1994

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Quantum-chemical calculations for silyl- and alkyl-pseudohalides X sub(3)YNCZ (X = H or CH sub(3); Y = C or Si; Z = O, S, or Se) and electron diffraction study of the equilibrium molecular structure of (CH sub(3)) sub(3)SiNCSe

Russian Journal of Physical Chemistry A, Focus on Chemistry, 2014-04, Vol.88 (4), p.657-660

2014

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Quantum-chemical calculations for silyl- and alkyl-pseudohalides X3YNCZ (X = H or CH3; Y = C or Si; Z = O, S, or Se) and electron diffraction study of the equilibrium molecular structure of (CH3)3SiNCSe

Russian Journal of Physical Chemistry A, 2014-04, Vol.88 (4), p.657-660

2014

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Molecular Structures of Acetylene Derivatives of Tin. VIII Trimethylstannylacetylene: Use of Results of Quantum-Chemical Calculations and Spectroscopic Measurements in Analysis of Gas-Phase Electron Diffraction Data

Structural chemistry, 2004-02, Vol.15 (1), p.17-30

2004

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Hexamethylenetetramine (urotropine) C6H12N2: Interpreting the vibrational spectra of -d0 and -d12 isotopomers by scaling the quantum-chemical force field

Russian Journal of Physical Chemistry A, 2014-03, Vol.88 (3), p.450-456

2014

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An analysis of electron diffraction data on bis(trimethylsilyl)acetylene taking into account nonlinear relations between Cartesian and internal vibrational coordinates

Journal of molecular structure, 2000-05, Vol.523 (1-3), p.23-37

2000

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Interpreting the vibrational spectra of uracil molecules and their deuterated isotopomers using a scaled quantum-chemical quadratic force field

Russian Journal of Physical Chemistry A, 2012-12, Vol.86 (12), p.1855-1861

2012

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A quantum-chemical and gas phase electron diffraction study of the structure of formylphosphine and acetyldimethylphosphine

Russian Journal of Physical Chemistry A, 2010-10, Vol.84 (10), p.1745-1751

2010

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Some problems in the stereochemistry of nitrogen compounds in the gas phase

Russian chemical reviews, 1992-12, Vol.61 (12), p.1169-1193

1992

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Molecular structures of acetylene derivatives of tin: 6. Molecular structure of bis(trimethylstannyl)acetylene and analysis of vibrational spectra of its isotopomers by scaling of quantum-chemical force field

Russian chemical bulletin, 2000-04, Vol.49 (4), p.620-630

2000

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Molecular structures of acetylene derivatives of tin: 7. Bis(trimethylstannyl)acetylene: analysis of electron diffraction data taking into account nonlinear relations between Cartesian and internal vibrational coordinates

Russian chemical bulletin, 2000-04, Vol.49 (4), p.631-641

2000

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The geometry of the nitroguanyl fragment in the simplest nitroguanidine derivatives in the absence of intermolecular interactions: The gas electron diffraction data on 1,1,3,3-tetramethyl-2-nitroguanidine

Russian Journal of Physical Chemistry A, 2011-03, Vol.85 (3), p.441-446

2011

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Vibrational spectra of 1,1,3,3-tetramethyl-2-nitroguanidine and their interpretation with the use of scaling of quantum-chemical force field

Russian chemical bulletin, 2008-03, Vol.57 (3), p.499-505

2008

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Tautomeric and conformational stabilities of methylphosphonic dicyanide, methoxydicyanophosphine, and their isocyano analogs: an ab initio calculation

Journal of molecular structure, 1995-11, Vol.356 (3), p.239-246

1995

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Gas-phase electron diffraction study of cyclic dimer of dimethylphosphinic acid (Me 2P(O)OH) 2 using quantum chemical data and a priori force field

Journal of molecular structure, 2003-10, Vol.658 (3), p.153-170

2003

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Intramolecular Motions in 1,2,3-Triethyldiaziridine: A Quantum Chemistry Study

The Equilibrium Molecular Structure of 4-Cyanopyridine According to a Combined Analysis of Gas-Phase Electron Diffraction and Microwave Data and Coupled-Cluster Computations

Electron diffraction study of the equilibrium structure of hexamethylenetetramine involving data from quantum chemistry and vibrational spectroscopy

Structure, spectra and internal rotation of bis(trimethylsilyl) acetylene: spectral analysis by scaling quantum-chemical force fields and two methods for calculating vibrational effects

Analysis of electron diffraction data for several symmetric coordinates of large-amplitude motions in the case of the 1,3,5-trinitrobenzene molecule

Internal Rotation in Tolane: Molecular Structure in Gas and Crystal Phases

The structure and spectra of 1,1-bis(trimethylsilylethynyl)-cyclopropane: a priori calculated force field and vibrational effects

The structure and spectra of 1-silylpropyne: scaled quantum-chemical force fields and vibrational effects

Structure, spectra, and intramolecular motions of 1,4-bis(trimethylsilyl)-1,3-butadiyne: an electron diffraction study using the results of spectral analysis based on scaled quantum-chemical force field for calculating vibrational effects

Quantum-chemical calculations and electron diffraction study of the equilibrium molecular structure of vitamin K3

The structure of nitrobenzene and the interpretation of the vibrational frequencies of the C-NO2 moiety on the basis of ab initio calculations

Quantum-chemical calculations for silyl- and alkyl-pseudohalides X sub(3)YNCZ (X = H or CH sub(3); Y = C or Si; Z = O, S, or Se) and electron diffraction study of the equilibrium molecular structure of (CH sub(3)) sub(3)SiNCSe

Quantum-chemical calculations for silyl- and alkyl-pseudohalides X3YNCZ (X = H or CH3; Y = C or Si; Z = O, S, or Se) and electron diffraction study of the equilibrium molecular structure of (CH3)3SiNCSe

Molecular Structures of Acetylene Derivatives of Tin. VIII Trimethylstannylacetylene: Use of Results of Quantum-Chemical Calculations and Spectroscopic Measurements in Analysis of Gas-Phase Electron Diffraction Data

Hexamethylenetetramine (urotropine) C6H12N2: Interpreting the vibrational spectra of -d0 and -d12 isotopomers by scaling the quantum-chemical force field

An analysis of electron diffraction data on bis(trimethylsilyl)acetylene taking into account nonlinear relations between Cartesian and internal vibrational coordinates

Interpreting the vibrational spectra of uracil molecules and their deuterated isotopomers using a scaled quantum-chemical quadratic force field

A quantum-chemical and gas phase electron diffraction study of the structure of formylphosphine and acetyldimethylphosphine

Some problems in the stereochemistry of nitrogen compounds in the gas phase

Molecular structures of acetylene derivatives of tin: 6. Molecular structure of bis(trimethylstannyl)acetylene and analysis of vibrational spectra of its isotopomers by scaling of quantum-chemical force field

Molecular structures of acetylene derivatives of tin: 7. Bis(trimethylstannyl)acetylene: analysis of electron diffraction data taking into account nonlinear relations between Cartesian and internal vibrational coordinates

The geometry of the nitroguanyl fragment in the simplest nitroguanidine derivatives in the absence of intermolecular interactions: The gas electron diffraction data on 1,1,3,3-tetramethyl-2-nitroguanidine

Vibrational spectra of 1,1,3,3-tetramethyl-2-nitroguanidine and their interpretation with the use of scaling of quantum-chemical force field

Tautomeric and conformational stabilities of methylphosphonic dicyanide, methoxydicyanophosphine, and their isocyano analogs: an ab initio calculation

Gas-phase electron diffraction study of cyclic dimer of dimethylphosphinic acid (Me 2P(O)OH) 2 using quantum chemical data and a priori force field

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