Molecular Structures and Force Fields of Monomeric and Dimeric Magnesium Dichloride from Electron Diffraction and Quantum Chemical Calculations

Judit Molnar; Colin J. Marsden; Magdolna Hargittai

doi:10.1021/j100022a018

Molecular Structures and Force Fields of Monomeric and Dimeric Magnesium Dichloride from Electron Diffraction and Quantum Chemical Calculations

The Journal of Physical Chemistry ◽

10.1021/j100022a018 ◽

1995 ◽

Vol 99 (22) ◽

pp. 9062-9071 ◽

Cited By ~ 19

Author(s):

Judit Molnar ◽

Colin J. Marsden ◽

Magdolna Hargittai

Keyword(s):

Electron Diffraction ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Force Fields ◽

Molecular Structures

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The molecular structures, conformations and force fields of bis(chloroimino)butanedinitrile as studied by gas-phase electron diffraction and quantum chemical calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2009.03.032 ◽

2009 ◽

Vol 928 (1-3) ◽

pp. 182-188 ◽

Cited By ~ 1

Author(s):

H. Thomassen ◽

S. Gundersen ◽

S. Samdal

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Force Fields ◽

Molecular Structures ◽

Gas Phase Electron Diffraction

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Molecular structures, conformations, force fields and large amplitude motion of cis-3-chloro-2-propen-1-ol as studied by quantum chemical calculations and gas electron diffraction augmented with quantum chemical calculations on 2-propen-1-ol

Journal of Molecular Structure ◽

10.1016/j.molstruc.2008.12.036 ◽

2009 ◽

Vol 921 (1-3) ◽

pp. 72-79 ◽

Cited By ~ 4

Author(s):

Tor G. Strand ◽

Snefrid Gundersen ◽

Hanno Priebe ◽

Svein Samdal ◽

Ragnhild Seip

Keyword(s):

Electron Diffraction ◽

Quantum Chemical Calculations ◽

Large Amplitude ◽

Quantum Chemical ◽

Force Fields ◽

Molecular Structures ◽

Gas Electron Diffraction ◽

Large Amplitude Motion

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Molecular Structures of Chloro(phthalocyaninato)-aluminum(III) and -gallium(III) as Determined by Gas Electron Diffraction and Quantum Chemical Calculations: Quantum Chemical Calculations on Fluoro(phthalocyaninato)-aluminum(III) and -gallium(III), Chloro(tetrakis(1,2,5-thiadiazole)porphyrazinato)-aluminum(III) and -gallium(III) and Comparison with their X-ray Structures

The Journal of Physical Chemistry A ◽

10.1021/jp804105d ◽

2008 ◽

Vol 112 (38) ◽

pp. 9075-9082 ◽

Cited By ~ 18

Author(s):

Tatyana Strenalyuk ◽

Svein Samdal ◽

Hans Vidar Volden

Keyword(s):

Electron Diffraction ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

Gas Electron Diffraction ◽

X Ray

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Molecular Structures of Phthalocyaninatozinc and Hexadecafluorophthalocyaninatozinc Studied by Gas-Phase Electron Diffraction and Quantum Chemical Calculations

The Journal of Physical Chemistry A ◽

10.1021/jp074455n ◽

2007 ◽

Vol 111 (47) ◽

pp. 12011-12018 ◽

Cited By ~ 19

Author(s):

Tatyana Strenalyuk ◽

Svein Samdal ◽

Hans Vidar Volden

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

Gas Phase Electron Diffraction

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Molecular structures of 2-methoxyphenol and 1,2-dimethoxybenzene as studied by gas-phase electron diffraction and quantum chemical calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2009.06.009 ◽

2009 ◽

Vol 933 (1-3) ◽

pp. 132-141 ◽

Cited By ~ 16

Author(s):

Olga V. Dorofeeva ◽

Igor F. Shishkov ◽

Nikolai M. Karasev ◽

Lev V. Vilkov ◽

Heinz Oberhammer

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

Gas Phase Electron Diffraction

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Molecular structures and conformations of 4-fluoranisole and 3,4-difluoranisole: gas electron diffraction and quantum chemical calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2004.06.002 ◽

2004 ◽

Vol 703 (1-3) ◽

pp. 55-62 ◽

Cited By ~ 16

Author(s):

Nina I Giricheva ◽

Georgiy V Girichev ◽

Julia S Levina ◽

Heinz Oberhammer

Keyword(s):

Electron Diffraction ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

Gas Electron Diffraction

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Molecular structures of free quinuclidine and its adducts with metal trihydrides, MH3 (M = B, Al or Ga), studied by gas-phase electron diffraction, X-ray diffraction and quantum chemical calculations

Dalton Transactions ◽

10.1039/b701476g ◽

2007 ◽

pp. 1687 ◽

Cited By ~ 14

Author(s):

Derek A. Wann ◽

Frank Blockhuys ◽

Christian Van Alsenoy ◽

Heather E. Robertson ◽

Hans-J?rg Himmel ◽

...

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

X Ray Diffraction ◽

X Ray ◽

Gas Phase Electron Diffraction

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Molecular structures of tetrabromothiophene and -selenophene as determined by gas-phase electron diffraction and high-level quantum chemical calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2012.07.004 ◽

2012 ◽

Vol 1030 ◽

pp. 75-82 ◽

Cited By ~ 2

Author(s):

Yuriy A. Zhabanov ◽

Christophe M.L. Vande Velde ◽

Frank Blockhuys ◽

Sergey A. Shlykov

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

High Level ◽

Gas Phase Electron Diffraction

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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 ◽

10.1023/b:stuc.0000010465.23794.d0 ◽

2004 ◽

Vol 15 (1) ◽

pp. 17-30 ◽

Cited By ~ 2

Author(s):

L. S. Khaikin ◽

O. E. Grikina ◽

A. A. Granovsky ◽

V. S. Nikitin ◽

L. V. Vilkov

Keyword(s):

Electron Diffraction ◽

Gas Phase ◽

Quantum Chemical Calculations ◽

Diffraction Data ◽

Quantum Chemical ◽

Molecular Structures ◽

Electron Diffraction Data ◽

Derivatives Of ◽

Gas Phase Electron Diffraction ◽

Acetylene Derivatives

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Dative σ- and π-bonding in boron–nitrogen compounds: molecular structures of (CH3)2NB(CH3)N(CH3)B(CH3)2 and [(CH3)2B]2NN(CH3)2 determined by gas electron diffraction and quantum chemical calculations

Dalton Transactions ◽

10.1039/b500659g ◽

2005 ◽

pp. 2284 ◽

Cited By ~ 11

Author(s):

Kari-Anne Østby ◽

Grete Gundersen ◽

Arne Haaland ◽

Heinrich Nöth

Keyword(s):

Electron Diffraction ◽

Quantum Chemical Calculations ◽

Quantum Chemical ◽

Molecular Structures ◽

Gas Electron Diffraction ◽

Nitrogen Compounds ◽

Boron Nitrogen

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