Gas-phase structure of sulfur cyanate pentafluoride, SF5OCN. Electron diffraction and ab initio study

Petra. Zylka; Hans Georg. Mack; Arno. Schmuck; Konrad. Seppelt; Heinz. Oberhammer

doi:10.1021/ic00001a012

Gas-phase structure of sulfur cyanate pentafluoride, SF5OCN. Electron diffraction and ab initio study

Inorganic Chemistry ◽

10.1021/ic00001a012 ◽

1991 ◽

Vol 30 (1) ◽

pp. 59-62 ◽

Cited By ~ 7

Author(s):

Petra. Zylka ◽

Hans Georg. Mack ◽

Arno. Schmuck ◽

Konrad. Seppelt ◽

Heinz. Oberhammer

Keyword(s):

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Ab Initio Study ◽

Gas Phase Structure

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ChemInform Abstract: Gas-Phase Structure and Conformations of Malonyl Difluoride (COF-CH2- COF) and Difluoromalonyl Difluoride (COF-CF2-COF). An Electron Diffraction and ab initio Study.

ChemInform ◽

10.1002/chin.199205049 ◽

2010 ◽

Vol 23 (5) ◽

pp. no-no

Author(s):

A. JIN ◽

H.-G. MACK ◽

A. WATERFELD ◽

H. OBERHAMMER

Keyword(s):

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Ab Initio Study ◽

Gas Phase Structure

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Gas-phase structure and conformations of malonyl difluoride (COF-CH2-COF) and difluoromalonyl difluoride (COF-CF2-COF). An electron diffraction and ab initio study

Journal of the American Chemical Society ◽

10.1021/ja00021a003 ◽

1991 ◽

Vol 113 (21) ◽

pp. 7847-7852 ◽

Cited By ~ 22

Author(s):

AnDing Jin ◽

Hans Georg Mack ◽

Alfred Waterfeld ◽

Heinz Oberhammer

Keyword(s):

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Ab Initio Study ◽

Gas Phase Structure

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Gas-Phase Structure and Acidity of Formohydroxamic Acid and Formamide: A Comparative ab Initio Study

The Journal of Physical Chemistry ◽

10.1021/j100001a023 ◽

1995 ◽

Vol 99 (1) ◽

pp. 131-136 ◽

Cited By ~ 28

Author(s):

Oscar N. Ventura ◽

Jose B. Rama ◽

Laszlo Turi ◽

J. J. Dannenberg

Keyword(s):

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Ab Initio Study ◽

Gas Phase Structure ◽

Formohydroxamic Acid

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Gas-Phase Structure of Protonated Histidine and Histidine Methyl Ester: Combined Experimental Mass Spectrometry and Theoretical ab Initio Study

The Journal of Physical Chemistry A ◽

10.1021/jp053288t ◽

2005 ◽

Vol 109 (37) ◽

pp. 8329-8335 ◽

Cited By ~ 28

Author(s):

Borislav Kovačević ◽

Marko Rožman ◽

Leo Klasinc ◽

Dunja Srzić ◽

Zvonimir B. Maksić ◽

...

Keyword(s):

Mass Spectrometry ◽

Methyl Ester ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Ab Initio Study ◽

Gas Phase Structure

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Inductive and Steric Effects on the Gas-Phase Structure of tert-Butyl Acetate. Electron Diffraction and ab Initio MO Investigations

The Journal of Physical Chemistry ◽

10.1021/j100086a008 ◽

1994 ◽

Vol 98 (35) ◽

pp. 8632-8635 ◽

Cited By ~ 16

Author(s):

Hiroshi Takeuchi ◽

J. Enmi ◽

Manabu Onozaki ◽

Toru Egawa ◽

Shigehiro Konaka

Keyword(s):

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Butyl Acetate ◽

Steric Effects ◽

Tert Butyl ◽

Ab Initio Mo ◽

Gas Phase Structure

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Ab initio study of the gas-phase structure and electronic properties of M–CH3 (M=Li, Na) and M–CCH (M=Li, Na, K): A combined post-Hartree–Fock and density functional theory study

The Journal of Chemical Physics ◽

10.1063/1.480671 ◽

2000 ◽

Vol 112 (3) ◽

pp. 1178-1191 ◽

Cited By ~ 21

Author(s):

G. Scalmani ◽

J. L. Brédas ◽

V. Barone

Keyword(s):

Density Functional Theory ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Density Functional ◽

Ab Initio Study ◽

Density Functional Theory Study ◽

Functional Theory ◽

Hartree Fock ◽

Gas Phase Structure

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Conformational properties and gas-phase structure of (fluorocarbonyl)sulfenyl chloride, FC(O)SCl; electron diffraction, vibrational analysis, and ab initio calculations

The Journal of Physical Chemistry ◽

10.1021/j100164a014 ◽

1991 ◽

Vol 95 (11) ◽

pp. 4238-4241 ◽

Cited By ~ 30

Author(s):

Hans Georg Mack ◽

Heinz Oberhammer ◽

C. O. Della Vedova

Keyword(s):

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Vibrational Analysis ◽

Sulfenyl Chloride ◽

Conformational Properties ◽

Gas Phase Structure

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Gas-phase structure of nickel dichloride. An electron-diffraction investigation augmented by ab initio and DFT calculations

Journal of Molecular Structure ◽

10.1016/j.molstruc.2018.12.100 ◽

2019 ◽

Vol 1182 ◽

pp. 294-297

Author(s):

Larry L. Eddy ◽

Kenneth Hedberg

Keyword(s):

Electron Diffraction ◽

Dft Calculations ◽

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Electron Diffraction Investigation ◽

Gas Phase Structure ◽

Ab Initio And Dft

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Gas phase structure of beryllocene, an ab initio LCAO MO SCF study

Chemical Physics Letters ◽

10.1016/0009-2614(78)85288-9 ◽

1978 ◽

Vol 54 (3) ◽

pp. 567-570 ◽

Cited By ~ 18

Author(s):

J. Demuynck ◽

M.M. Rohmer

Keyword(s):

Ab Initio ◽

Gas Phase ◽

Phase Structure ◽

Gas Phase Structure ◽

Lcao Mo

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Conformation and structure of 1,1,1,4,4,4-hexafluorobutane. A gas-phase electron diffraction and ab initio study

Journal of Molecular Structure ◽

10.1016/0022-2860(92)87097-f ◽

1992 ◽

Vol 273 ◽

pp. 317-322 ◽

Cited By ~ 3

Author(s):

Hans-Georg Mack ◽

Heinz Oberhammer ◽

Dietmar Bielefeldt

Keyword(s):

Electron Diffraction ◽

Ab Initio ◽

Gas Phase ◽

Ab Initio Study ◽

Gas Phase Electron Diffraction

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