Molecular structure and conformational composition of 1-Chlorobutane, 1-Bromobutane, and 1-Iodobutane as determined by gas-phase electron diffraction and ab initio calculations

Kirsten Aarset; Kolbjørn Hagen; Reidar Stølevik; Sæbø Per Christian

doi:10.1007/bf02286448

Molecular structure and conformational composition of 1-Chlorobutane, 1-Bromobutane, and 1-Iodobutane as determined by gas-phase electron diffraction and ab initio calculations

Structural Chemistry ◽

10.1007/bf02286448 ◽

1995 ◽

Vol 6 (3) ◽

pp. 197-205 ◽

Cited By ~ 18

Author(s):

Kirsten Aarset ◽

Kolbjørn Hagen ◽

Reidar Stølevik ◽

Sæbø Per Christian

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Conformational Composition ◽

Gas Phase Electron Diffraction

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Molecular structure and conformational composition of 1-iodopropane as determined from gas-phase electron diffraction, microwave spectroscopy data and ab initio calculations

Journal of Molecular Structure ◽

10.1016/0022-2860(94)09003-8 ◽

1995 ◽

Vol 346 ◽

pp. 75-82 ◽

Cited By ~ 7

Author(s):

Kolbjørn Hagen ◽

Reidar Stølevik ◽

Per Christian Sæbø

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Microwave Spectroscopy ◽

Spectroscopy Data ◽

Conformational Composition ◽

Gas Phase Electron Diffraction

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ChemInform Abstract: The Molecular Structure and Conformational Behaviour of 2-Chloro-1,3- butadiene (Chloroprene) Studied by Gas-Phase Electron Diffraction and ab initio Calculations.

ChemInform ◽

10.1002/chin.199123053 ◽

2010 ◽

Vol 22 (23) ◽

pp. no-no

Author(s):

G. GUNDERSEN ◽

H. G. THOMASSEN ◽

J. E. BOGGS ◽

C. PENG

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Gas Phase Electron Diffraction

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Molecular structure of trimethylamine–gallane, Me3N·GaH3: ab initio calculations, gas-phase electron diffraction and single-crystal X-ray diffraction studies †

Journal of the Chemical Society Dalton Transactions ◽

10.1039/a806289g ◽

1998 ◽

pp. 3685-3692 ◽

Cited By ~ 24

Author(s):

Paul T. Brain ◽

Helen E. Brown ◽

Anthony J. Downs ◽

Tim M. Greene ◽

Emma Johnsen ◽

...

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Single Crystal ◽

Ab Initio ◽

Gas Phase ◽

X Ray Diffraction ◽

X Ray ◽

Gas Phase Electron Diffraction

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A study of the asymmetry of ligands in bis(trichlorosilyl)tert-butylphosphine, PBut(SiCl3)2: molecular structure by gas-phase electron diffraction and ab initio calculations

Journal of the Chemical Society Dalton Transactions ◽

10.1039/b204823j ◽

2002 ◽

pp. 3787 ◽

Cited By ~ 5

Author(s):

Sarah L. Hinchley ◽

Heather E. Robertson ◽

David W. H. Rankin ◽

Wolf-W. du Mont

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

The Asymmetry ◽

Gas Phase Electron Diffraction

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Molecular structure and conformational composition of 2-chloropropanal, a gas-phase electron-diffraction and ab initio investigation

The Journal of Physical Chemistry ◽

10.1021/j100143a023 ◽

1993 ◽

Vol 97 (41) ◽

pp. 10670-10673 ◽

Cited By ~ 1

Author(s):

Kirsten Aarset ◽

Kolbjoern Hagen ◽

Gernot Frenking ◽

Arno Wehrsig

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Conformational Composition ◽

Gas Phase Electron Diffraction

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The equilibrium molecular structure of 2-cyanopyridine from combined analysis of gas-phase electron diffraction and microwave data and results of ab initio calculations

Structural Chemistry ◽

10.1007/s11224-019-01393-y ◽

2019 ◽

Vol 30 (5) ◽

pp. 1699-1706 ◽

Cited By ~ 1

Author(s):

Natalja Vogt ◽

Leonid S. Khaikin ◽

Anatoliy N. Rykov ◽

Olga E. Grikina ◽

Anatoly A. Batiukov ◽

...

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Combined Analysis ◽

Equilibrium Molecular Structure ◽

Gas Phase Electron Diffraction ◽

Microwave Data

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Molecular structure and conformational composition of 1,1-dichlorobutane: a gas-phase electron diffraction and ab initio investigation

Journal of Molecular Structure ◽

10.1016/s0022-2860(97)00162-2 ◽

1997 ◽

Vol 413-414 ◽

pp. 241-248 ◽

Cited By ~ 3

Author(s):

Kirsten Aarset ◽

Kolbjørn Hagen ◽

Reidar Stølevik

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Conformational Composition ◽

Gas Phase Electron Diffraction

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The molecular structure of fluoromalononitrile as determined by gas-phase electron diffraction and ab initio calculations

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2004.11.067 ◽

2005 ◽

Vol 61 (7) ◽

pp. 1671-1674 ◽

Cited By ~ 1

Author(s):

E.G. Atavin ◽

M. Dakkouri ◽

L.V. Khristenko ◽

L.V. Vilkov

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Gas Phase Electron Diffraction

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The molecular structure and conformations of 3-ethenyl-3-methyl-cyclopropene as determined by ab initio calculations and gas-phase electron diffraction

Journal of Molecular Structure ◽

10.1016/s0022-2860(98)00417-7 ◽

1998 ◽

Vol 445 (1-3) ◽

pp. 107-115 ◽

Cited By ~ 2

Author(s):

Pirkko Bakken ◽

Ivan Bolesov ◽

Ilia Kuchuk ◽

Armin de Meijere ◽

Vladimir Mastryukov ◽

...

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Gas Phase Electron Diffraction

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Conformational Composition of Gaseoustrans-1,4-Dichlorocyclohexane. Molecular Structures and Energy Differences of the aa and ee Components from Gas-Phase Electron Diffraction and ab Initio Calculations

The Journal of Physical Chemistry A ◽

10.1021/jp9914572 ◽

1999 ◽

Vol 103 (38) ◽

pp. 7709-7714 ◽

Cited By ~ 5

Author(s):

Alan D. Richardson ◽

Kenneth Hedberg ◽

Kenneth B. Wiberg

Keyword(s):

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Molecular Structures ◽

Conformational Composition ◽

Gas Phase Electron Diffraction

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