Synthesis, X-ray structure and Molecular Orbital study of a radical cation salt of a S-position isomer of an EDT-TTF derivative: C.l3 where C = 6, 7-dimethylsulfanyl-2,3-(dithiabutane-1,4-diyl)tetrathiafulvalene

Soazig Le Moustarder; Piétrick Hudhomme; Bertrand Illien; Jean-françois Halet; Alain Gorgues; Amédée Riou

doi:10.1080/10587250008024420

Synthesis, X-ray structure and Molecular Orbital study of a radical cation salt of a S-position isomer of an EDT-TTF derivative: C.l3 where C = 6, 7-dimethylsulfanyl-2,3-(dithiabutane-1,4-diyl)tetrathiafulvalene

Molecular Crystals and Liquid Crystals Science and Technology Section A Molecular Crystals and Liquid Crystals ◽

10.1080/10587250008024420 ◽

2000 ◽

Vol 338 (1) ◽

pp. 61-74 ◽

Cited By ~ 3

Author(s):

Soazig Le Moustarder ◽

Piétrick Hudhomme ◽

Bertrand Illien ◽

Jean-françois Halet ◽

Alain Gorgues ◽

...

Keyword(s):

Molecular Orbital ◽

Radical Cation ◽

X Ray ◽

Position Isomer ◽

Radical Cation Salt ◽

Molecular Orbital Study ◽

Orbital Study

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X-ray crystal structure, dipole moment and theoretical molecular orbital study of the cognition activator dihydro-1H-pyrrolizine-3,5(2H, 6H)-dione (‘rolziracetam’)

European Journal of Medicinal Chemistry ◽

10.1016/0223-5234(89)90168-2 ◽

1989 ◽

Vol 24 (1) ◽

pp. 81-85 ◽

Cited By ~ 4

Author(s):

G BANDOLI ◽

A GRASSI ◽

C LIEGEOIS ◽

H LUMBROSO ◽

E MONTONERI ◽

...

Keyword(s):

Crystal Structure ◽

Dipole Moment ◽

Molecular Orbital ◽

X Ray ◽

Molecular Orbital Study ◽

Orbital Study

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An ab initio molecular orbital study of the CH2O+− isomers: The stability of the hydroxymethylene radical cation

International Journal of Mass Spectrometry and Ion Physics ◽

10.1016/0020-7381(80)80038-6 ◽

1980 ◽

Vol 33 (1) ◽

pp. 87-93 ◽

Cited By ~ 19

Author(s):

Willem J. Bouma ◽

John K. Macleod ◽

Leo Radom

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Radical Cation ◽

Molecular Orbital Study ◽

Orbital Study ◽

The Stability

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X-RAY CRYSTAL STRUCTURE, DIPOLE MOMENT AND THEORETICAL MOLECULAR ORBITAL STUDY OF 5-NITRO-2- (2-PYRIDINYLTHIO)-PYRIDINE

Phosphorus Sulfur and Silicon and the Related Elements ◽

10.1080/10426508908045018 ◽

1989 ◽

Vol 45 (3-4) ◽

pp. 197-205 ◽

Cited By ~ 5

Author(s):

Maria E. Amato ◽

Giuliano Bandoli ◽

Antonio Grassi ◽

Giuseppe C. Pappalardo ◽

Guiseppe Scarlata

Keyword(s):

Crystal Structure ◽

Dipole Moment ◽

Molecular Orbital ◽

X Ray ◽

Molecular Orbital Study ◽

Orbital Study

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Bonding properties of the methyl isocyanide ligand. Single-crystal x-ray diffraction and molecular orbital study of bromotricarbonylbis(methyl isocyanide)manganese, Mn(CO)3(CNCH3)2Br

Inorganic Chemistry ◽

10.1021/ic50118a029 ◽

1972 ◽

Vol 11 (12) ◽

pp. 3021-3025 ◽

Cited By ~ 28

Author(s):

Allen C. Sarapu ◽

Richard F. Fenske

Keyword(s):

Single Crystal ◽

Molecular Orbital ◽

X Ray Diffraction ◽

X Ray ◽

Molecular Orbital Study ◽

Orbital Study ◽

Methyl Isocyanide ◽

Bonding Properties

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Anab InitioComputational Molecular Orbital Study of Radical, Protonated Radical (Radical Cation), and Carbocation Species That Have Been Proposed in Mechanisms for the Transfer Process in the Enzyme−Coenzyme B12-Catalyzed Dehydration of 1,2-Dihydroxyethane

Journal of the American Chemical Society ◽

10.1021/ja963424v ◽

1997 ◽

Vol 119 (30) ◽

pp. 7065-7074 ◽

Cited By ~ 14

Author(s):

Philip George ◽

Jenny P. Glusker ◽

Charles W. Bock

Keyword(s):

Molecular Orbital ◽

Radical Cation ◽

Transfer Process ◽

Coenzyme B12 ◽

Molecular Orbital Study ◽

Orbital Study

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Hydrogen Atoms in Boehmite: A Single Crystal X-Ray Diffraction and Molecular Orbital Study

Clays and Clay Minerals ◽

10.1346/ccmn.1981.0290604 ◽

1981 ◽

Vol 29 (6) ◽

pp. 435-445 ◽

Cited By ~ 38

Author(s):

Roderick J. Hill

Keyword(s):

Single Crystal ◽

Molecular Orbital ◽

X Ray Diffraction ◽

Hydrogen Atoms ◽

X Ray ◽

Molecular Orbital Study ◽

Orbital Study

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Novel S–N ring contractions using the 4-phenyl-1,2,3,5-dithiadiazole dimer, the synthesis and X-ray crystal structures of [(PhCN2S2)2Cl][S3N3], [PhCN2S2][S3N3], and [PhCN2S2][S3N2]Cl, and an ab initio molecular-orbital study of the bonding in [PhCN2S2][S3N3]

Journal of the Chemical Society Dalton Transactions ◽

10.1039/dt9900002793 ◽

1990 ◽

pp. 2793-2802 ◽

Cited By ~ 24

Author(s):

Arthur J. Banister ◽

Michael I. Hansford ◽

Zdenek V. Hauptman ◽

Anthony W. Luke ◽

Simon T. Wait ◽

...

Keyword(s):

Ab Initio ◽

Crystal Structures ◽

Molecular Orbital ◽

X Ray ◽

Molecular Orbital Study ◽

Orbital Study

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ChemInform Abstract: Novel S-N Ring Contractions Using the 4-Phenyl-1,2,3,5-dithiadiazole Dimer, the Synthesis and X-Ray Crystal Structures of ((PhCN2S2)2Cl)(S3N3), (PhCN2S2)(S3N3), and (PhCN2S2)(S3N2)Cl, and an ab initio Molecular-Orbital Study of the Bo

ChemInform ◽

10.1002/chin.199051184 ◽

1990 ◽

Vol 21 (51) ◽

Author(s):

A. J. BANISTER ◽

M. I. HANSFORD ◽

Z. V. HAUPTMAN ◽

A. W. LUKE ◽

S. T. WAIT ◽

...

Keyword(s):

Ab Initio ◽

Crystal Structures ◽

Molecular Orbital ◽

X Ray ◽

Molecular Orbital Study ◽

Orbital Study

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ChemInform Abstract: SEMI-EMPIRICAL MOLECULAR ORBITAL STUDY OF THE DIBORONTETRAHYDRIDE MOLECULE

Chemischer Informationsdienst ◽

10.1002/chin.197817007 ◽

1978 ◽

Vol 9 (17) ◽

Author(s):

M. K. DATTA ◽

R. DATTA

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Study ◽

Orbital Study ◽

Semi Empirical

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ChemInform Abstract: MOLECULAR ORBITAL STUDY OF SUBSTITUTED TRIMETHYLENEMETHANE-BIS(PHOSPHINE)PALLADIUM COMPLEXES

Chemischer Informationsdienst ◽

10.1002/chin.198201084 ◽

1982 ◽

Vol 13 (1) ◽

Author(s):

D. J. GORDON ◽

R. F. FENSKE ◽

T. N. NANNINGA ◽

B. M. TROST

Keyword(s):

Molecular Orbital ◽

Palladium Complexes ◽

Molecular Orbital Study ◽

Orbital Study

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