ChemInform Abstract: Conformational Analysis of Organic Carbonyl Compounds. Part 10. Ab initio MO Calculations of the Conformational Properties of 3-Formyl-furan, -thiophene, and -pyrrole

10.1002/chin.198850046 ◽

1988 ◽

Vol 19 (50) ◽

Author(s):

R. BENASSI ◽

U. FOLLI ◽

L. SCHENETTI ◽

F. TADDEI

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Carbonyl Compounds ◽

Mo Calculations ◽

Ab Initio Mo Calculations ◽

Conformational Properties ◽

Download Full-text

Conformational analysis of organic carbonyl compounds. Part 10. Ab-initio MO calculations of the conformational properties of 3-formyl-furan, -thio-phene, and -pyrrole

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29880001501 ◽

1988 ◽

pp. 1501 ◽

Author(s):

Rois Benassi ◽

Ugo Folli ◽

Luisa Schenetti ◽

Ferdinando Taddei

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Carbonyl Compounds ◽

Mo Calculations ◽

Ab Initio Mo Calculations ◽

Conformational Properties ◽

Download Full-text

ChemInform Abstract: Conformational Analysis of Organic Carbonyl Compounds. Part 11. Conformational Properties of Difuryl, Dithienyl, and Furyl Thienyl Ketones Studied by X-Ray Crystallography, NMR Lanthanoid-Induced Shifts and ab initio MO Calculations.

10.1002/chin.199009034 ◽

1990 ◽

Vol 21 (9) ◽

Author(s):

R. BENASSI ◽

U. FOLLI ◽

D. IAROSSI ◽

L. SCHENETTI ◽

F. TADDEI ◽

...

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Carbonyl Compounds ◽

Mo Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Ab Initio Mo Calculations ◽

Conformational Properties ◽

Download Full-text

ChemInform Abstract: Conformational Analysis of Organic Carbonyl Compounds. Part 7. Conformational Properties of Aroyl Derivatives of Furan and Benzo(b)furan Studied by X-Ray Crystallography, NMR Lanthanoid-Induced Shifts, and ab initio MO Calculations

10.1002/chin.198804066 ◽

1988 ◽

Vol 19 (4) ◽

Author(s):

R. BENASSI ◽

U. FOLLI ◽

D. IAROSSI ◽

L. SCHENETTI ◽

F. TADDEI ◽

...

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Carbonyl Compounds ◽

Mo Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Ab Initio Mo Calculations ◽

Conformational Properties ◽

Ab Initio Mo ◽

Download Full-text

Conformational analysis of organic carbonyl compounds. Part 11. Conformational properties of difuryl, dithienyl, and furyl thienyl ketones studied by X-ray crystallography, n.m.r. lanthanide-induced shifts and ab-initio MO calculations

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29890001741 ◽

1989 ◽

pp. 1741 ◽

Author(s):

Rois Benassi ◽

Ugo Folli ◽

Dario Iarossi ◽

Luisa Schenetti ◽

Ferdinando Taddei ◽

...

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Carbonyl Compounds ◽

Mo Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Lanthanide Induced Shifts ◽

Ab Initio Mo Calculations ◽

Conformational Properties ◽

Download Full-text

Conformational analysis of organic carbonyl compounds. Part 7. Conformational properties of aroyl derivatives of furan and benzo [b] furan studied by X-ray crystallography, n.m.r. lanthanide-induced shifts, and ab-initio MO calculations

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/p29870001443 ◽

1987 ◽

pp. 1443 ◽

Author(s):

Rois Benassi ◽

Ugo Folli ◽

Dario Iarossi ◽

Luisa Schenetti ◽

Ferdinando Taddei ◽

...

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Carbonyl Compounds ◽

Mo Calculations ◽

X Ray ◽

X Ray Crystallography ◽

Lanthanide Induced Shifts ◽

Ab Initio Mo Calculations ◽

Conformational Properties ◽

Download Full-text

Conformational analysis of model compounds of non-ionic surfactants in aqueous solution: Raman spectroscopy and ab initio MO calculations

Journal of Molecular Structure ◽

10.1016/s0022-2860(10)80030-4 ◽

1994 ◽

Vol 311 ◽

pp. 205-210 ◽

Author(s):

Hiroshi Yoshida ◽

Kazunori Takikawa ◽

Ichiro Kaneko ◽

Hiroatsu Matsuura

Keyword(s):

Aqueous Solution ◽

Raman Spectroscopy ◽

Conformational Analysis ◽

Ab Initio ◽

Ionic Surfactants ◽

Mo Calculations ◽

Model Compounds ◽

Ab Initio Mo Calculations ◽

Download Full-text

Conformational analysis of model compounds of non-ionic surfactants in aqueous solution: Raman spectroscopy and ab initio MO calculations

Journal of Molecular Structure THEOCHEM ◽

10.1016/s0166-1280(09)80058-4 ◽

1994 ◽

Vol 311 ◽

pp. 205-210 ◽

Author(s):

Hiroshi Yoshida ◽

Kazunori Takikawa ◽

Ichiro Kaneko ◽

Hiroatsu Matsuura

Keyword(s):

Aqueous Solution ◽

Raman Spectroscopy ◽

Conformational Analysis ◽

Ab Initio ◽

Ionic Surfactants ◽

Mo Calculations ◽

Model Compounds ◽

Ab Initio Mo Calculations ◽

Download Full-text

Vibrational and conformational analysis of n-propylamine by means of i.r. spectroscopy and ab initio MO calculations

Spectrochimica Acta Part A Molecular Spectroscopy ◽

10.1016/0584-8539(87)80247-7 ◽

1987 ◽

Vol 43 (7) ◽

pp. 943-954 ◽

Author(s):

Nobuo Sato ◽

Yoshiaki Hamada ◽

Masamichi Tsuboi

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Mo Calculations ◽

Ab Initio Mo Calculations ◽

Download Full-text

Pyramidal inversion energies and conformational analysis of chalcogen-onium imides based on ab initio MO calculations †

Journal of the Chemical Society Perkin Transactions 2 ◽

10.1039/a900315k ◽

1999 ◽

pp. 1469-1474 ◽

Author(s):

Toshio Shimizu ◽

Nobumasa Kamigata ◽

Shigeru Ikuta

Keyword(s):

Conformational Analysis ◽

Ab Initio ◽

Mo Calculations ◽

Pyramidal Inversion ◽

Ab Initio Mo Calculations ◽

Download Full-text

Vibrational spectroscopic study of 2-methoxyethanol: matrix-isolation infrared spectra and conformational analysis based on ab initio MO calculations

Journal of Molecular Structure ◽

10.1016/0022-2860(93)80288-7 ◽

1993 ◽

Vol 299 ◽

pp. 141-147 ◽

Author(s):

Hiroshi Yoshida ◽

Kazunori Takikawa ◽

Keiichi Ohno ◽

Hiroatsu Matsuura

Keyword(s):

Conformational Analysis ◽

Spectroscopic Study ◽

Ab Initio ◽

Infrared Spectra ◽

Matrix Isolation ◽

Mo Calculations ◽

Ab Initio Mo Calculations ◽

Download Full-text