Molecular structure of jet-cooled thioanisole studied by laser-induced fluorescence spectroscopy and ab initio calculations: Planar and/or perpendicular conformation?

Ab Initio Calculations ◽

Ab Initio ◽

Laser Induced Fluorescence

Molecular structure of p -methylaniline and its van der Waals complexes with CF 3 H, CH 4 and CF 4 studied by laser induced fluorescence spectroscopy and ab initio calculations

Journal of Molecular Structure ◽

10.1016/s0022-2860(01)00784-0 ◽

2002 ◽

Vol 605 (2-3) ◽

pp. 255-276 ◽

Cited By ~ 27

Author(s):

B Ballesteros ◽

E Martı́nez ◽

L Santos ◽

J Sanchez-Marı́n

Keyword(s):

Molecular Structure ◽

Ab Initio Calculations ◽

Ab Initio ◽

Van Der Waals ◽

Van Der Waals Complexes

Molecular structure of van der Waals complex of o - and m -methylaniline with CF 3 Cl, CF 3 H, CF 4 and CH 4 studied by laser induced fluorescence spectroscopy and ab initio calculations

Journal of Molecular Structure ◽

10.1016/s0022-2860(02)00045-5 ◽

2002 ◽

Vol 612 (1) ◽

pp. 13-28 ◽

Cited By ~ 11

Author(s):

B. Ballesteros ◽

L. Santos ◽

E. Martı́nez

Keyword(s):

Molecular Structure ◽

Ab Initio Calculations ◽

Ab Initio ◽

Van Der Waals ◽

Van Der Waals Complex

A reinvestigation of the molecular structures, vibrations and rotation of methyl group in o-methylaniline in S0 and S1 states studied by laser induced fluorescence spectroscopy and ab initio calculations

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/s1386-1425(01)00582-0 ◽

2002 ◽

Vol 58 (5) ◽

pp. 1069-1081 ◽

Cited By ~ 30

Author(s):

B Ballesteros ◽

L Santos

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Molecular Structures ◽

Methyl Group

Molecular structures and vibrations of m-methylaniline in the S0 and S1 states studied by laser induced fluorescence spectroscopy and ab initio calculations

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/s1386-1425(00)00248-1 ◽

2000 ◽

Vol 56 (10) ◽

pp. 1905-1915 ◽

Cited By ~ 31

Author(s):

L Santos ◽

E Martı́nez ◽

B Ballesteros ◽

J Sanchez

Keyword(s):

Ab Initio Calculations ◽

Ab Initio ◽

Molecular Structures

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

ChemInform Abstract: Molecular Structure and Conformation of Gaseous 3-Azetidinol as Determined by Electron Diffraction and ab initio Calculations.

ChemInform ◽

10.1002/chin.199121051 ◽

2010 ◽

Vol 22 (21) ◽

pp. no-no

Author(s):

K. HAGEN ◽

H. V. VOLDEN ◽

U. ANTHONI ◽

C. CHRISTOPHERSEN ◽

M. GAJHEDE ◽

...

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio

The Molecular Structure of ortho- and meta-Iodonitrobenzene in the Gaseous State as Determined by the Electron Diffraction Method. General Trends in the Bond Lengths and STO-3G* Ab Initio Calculations on Iodonitrobenzenes.

Acta Chemica Scandinavica ◽

10.3891/acta.chem.scand.46-0712 ◽

1992 ◽

Vol 46 ◽

pp. 712-719 ◽

Cited By ~ 18

Author(s):

S. Samdal ◽

L. V. Vilkov ◽

H. V. Volden ◽

Erik Högfeldt ◽

P. Spielbüchler ◽

...

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Diffraction Method ◽

Gaseous State ◽

Bond Lengths

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

3-chloro-1-butene: gas-phase molecular structure and conformations as determined by electron diffraction and by molecular mechanics and ab initio calculations

Journal of Molecular Structure ◽

10.1016/0022-2860(84)87228-2 ◽

1984 ◽

Vol 118 (3-4) ◽

pp. 319-332 ◽

Cited By ~ 12

Author(s):

S.H. Schei

Keyword(s):

Molecular Structure ◽

Electron Diffraction ◽

Ab Initio Calculations ◽

Ab Initio ◽

Molecular Mechanics ◽

Gas Phase

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