Theoretical studies of organometallic compounds. I. All electron and pseudopotential calculations of Ti(CH3)nCl4 ?n (n = 0-4)

Volker Jonas; Gernot Frenking; Manfred T. Reetz

doi:10.1002/jcc.540130802

Theoretical studies of organometallic compounds. I. All electron and pseudopotential calculations of Ti(CH3)nCl4 ?n (n = 0-4)

Journal of Computational Chemistry ◽

10.1002/jcc.540130802 ◽

1992 ◽

Vol 13 (8) ◽

pp. 919-934 ◽

Cited By ~ 44

Author(s):

Volker Jonas ◽

Gernot Frenking ◽

Manfred T. Reetz

Keyword(s):

Organometallic Compounds ◽

Theoretical Studies ◽

Pseudopotential Calculations

Download Full-text

Theoretical studies of organometallic compounds. II. All electron and pseudopotential calculations ofM(CH3)nCl4 ?n (M = C, Si, Ge, Sn, Pb;n = 0-4)

Journal of Computational Chemistry ◽

10.1002/jcc.540130803 ◽

1992 ◽

Vol 13 (8) ◽

pp. 935-943 ◽

Cited By ~ 16

Author(s):

Volker Jonas ◽

Gernot Frenking ◽

Manfred T. Reetz

Keyword(s):

Organometallic Compounds ◽

Theoretical Studies ◽

Pseudopotential Calculations

Download Full-text

Theoretical Studies of Organometallic Compounds. XIX. Complexes of Transition Metals in High and Low Oxidation States with Side-On-Bonded .pi.-Ligands

Organometallics ◽

10.1021/om00011a058 ◽

1995 ◽

Vol 14 (11) ◽

pp. 5325-5336 ◽

Cited By ~ 55

Author(s):

Ulrich Pidun ◽

Gernot Frenking

Keyword(s):

Transition Metals ◽

Organometallic Compounds ◽

Oxidation States ◽

Theoretical Studies ◽

Complexes Of Transition Metals ◽

Pi Ligands

Download Full-text

Theoretical studies of organometallic compounds. III. Structures and bond energies of FeCHn and FeCHn+ (n = 1, 2, 3)

Journal of Computational Chemistry ◽

10.1002/jcc.540131003 ◽

1992 ◽

Vol 13 (10) ◽

pp. 1184-1198 ◽

Cited By ~ 15

Author(s):

Achim Veldkamp ◽

Gernot Frenking

Keyword(s):

Organometallic Compounds ◽

Theoretical Studies ◽

Bond Energies

Download Full-text

Electronic structure of organometallic compounds. 23. Preparation, physical nature, and theoretical studies of tetrakis(3-methylpentadienyl)trimanganese, Mn3(3-CH3C5H6)4

Inorganic Chemistry ◽

10.1021/ic00167a029 ◽

1983 ◽

Vol 22 (25) ◽

pp. 3815-3821 ◽

Cited By ~ 14

Author(s):

Michael C. Boehm ◽

Richard D. Ernst ◽

Rolf Gleiter ◽

David R. Wilson

Keyword(s):

Electronic Structure ◽

Organometallic Compounds ◽

Physical Nature ◽

Theoretical Studies

Download Full-text

Mass spectrometric and theoretical studies on the fragmentation mechanism of protonated molecules and molecular radical cations of organometallic compounds with SiC, SiSi, GeC and GeGe bonds

Surface and Interface Analysis ◽

10.1002/sia.2421 ◽

2006 ◽

Vol 38 (12-13) ◽

pp. 1650-1653 ◽

Cited By ~ 7

Author(s):

Takae Takeuchi ◽

Yuko Shirai ◽

Yuriko Matsumura ◽

Kaoru Iwai ◽

Takaomi Matsutani ◽

...

Keyword(s):

Organometallic Compounds ◽

Radical Cations ◽

Mass Spectrometric ◽

Theoretical Studies ◽

Fragmentation Mechanism ◽

Molecular Radical ◽

Protonated Molecules

Download Full-text

Theoretical Studies of Organometallic Compounds. XVII. Mechanism of the Chelation Controlled Addition of CH3TiCl3 to .alpha.-Alkoxy Carbonyl Compounds. A Theoretical Study

Organometallics ◽

10.1021/om00011a057 ◽

1995 ◽

Vol 14 (11) ◽

pp. 5316-5324 ◽

Cited By ~ 6

Author(s):

Volker Jonas ◽

Gernot Frenking ◽

Manfred T. Reetz

Keyword(s):

Carbonyl Compounds ◽

Theoretical Study ◽

Organometallic Compounds ◽

Theoretical Studies

Download Full-text

ChemInform Abstract: Theoretical Studies of Organometallic Compounds. Part 12. Theoretical Investigation of Transition Metal-Ligand Interactions Using the Charge Decomposition Analysis

ChemInform ◽

10.1002/chin.199638314 ◽

2010 ◽

Vol 27 (38) ◽

pp. no-no

Author(s):

G. FRENKING ◽

S. DAPPRICH ◽

A. W. EHLERS ◽

S. F. VYBOISHCHIKOV

Keyword(s):

Transition Metal ◽

Theoretical Investigation ◽

Decomposition Analysis ◽

Organometallic Compounds ◽

Theoretical Studies ◽

Charge Decomposition Analysis ◽

Ligand Interactions ◽

Metal Ligand

Download Full-text

Theoretical Studies of Organometallic Compounds. 9. Structures and Bond Energies of the Methylcuprates CH3Cu, (CH3)2Cu-, (CH3)2CuLi, (CH3)2CuLi.cntdot.H2O, [(CH3)2CuLi]2, and [(CH3)2CuLi]2.cntdot.2H2O

Organometallics ◽

10.1021/om00023a029 ◽

1994 ◽

Vol 13 (11) ◽

pp. 4237-4245 ◽

Cited By ~ 22

Author(s):

Marlis Boehme ◽

Gernot Frenking ◽

Manfred T. Reetz

Keyword(s):

Organometallic Compounds ◽

Theoretical Studies ◽

Bond Energies

Download Full-text

Theoretical Studies of Organometallic Compounds. 15. Si2H2 and CSiH2 Isomers as Ligands in High-Valent Transition Metal Complexes

Organometallics ◽

10.1021/om00011a056 ◽

1995 ◽

Vol 14 (11) ◽

pp. 5308-5315 ◽

Cited By ~ 12

Author(s):

Ralf Stegmann ◽

Gernot Frenking

Keyword(s):

Transition Metal ◽

Metal Complexes ◽

Transition Metal Complexes ◽

Organometallic Compounds ◽

Theoretical Studies ◽

High Valent

Download Full-text

ChemInform Abstract: ELECTRONIC STRUCTURE OF ORGANOMETALLIC COMPOUNDS. 23. PREPARATION, PHYSICAL NATURE, AND THEORETICAL STUDIES OF TETRAKIS(3-METHYLPENTADIENYL)TRIMANGANESE, MN3(3-CH3C5H6)4

Chemischer Informationsdienst ◽

10.1002/chin.198410266 ◽

1984 ◽

Vol 15 (10) ◽

Author(s):

M. C. BOEHM ◽

R. D. ERNST ◽

R. GLEITER ◽

D. R. WILSON

Keyword(s):

Electronic Structure ◽

Organometallic Compounds ◽

Physical Nature ◽

Theoretical Studies

Download Full-text