Computer-Chemie-Centrum (CCC)

EXO,EXO-[1,3-BIS(TRIMETHYLSILYL)ALLYL]LITHIUM N,N,N',N'-TETRAMETHYLETHYLENEDIAMINE COMPLEX - CRYSTAL-STRUCTURE AND DYNAMICS IN SOLUTION (1992) Boche G, Fraenkel G, Cabral J, Harms K, van Eikema Hommes N, Lohrenz J, Marsch M, Schleyer P Journal article MECHANISM OF THE ZIEGLER DILITHIOMETHANE SYNTHESIS - AN ABINITIO STUDY OF METHYLLITHIUM PYROLYSIS (1992) van Eikema Hommes N, Schleyer P, Wu YD Journal article CATALYSIS OF ETHYLENE DIMERIZATION BY COMPLEXATION WITH METAL RADICAL CATIONS - AN ABINITIO STUDY (1992) Alex A, Clark T Journal article 3-CENTER TRANSITION STRUCTURES FOR ALKENE HYDROBORATION AND ALKYLBORANE REARRANGEMENT (1991) van Eikema Hommes N, Schleyer P Journal article A COMPARATIVE THEORETICAL-STUDY OF THE ALLYL ALKALI-METALS (1991) van Eikema Hommes N, Bühl M, Schleyer P, Wu YD Journal article ALLYLBORANE AND ITS ISOMERS - AN ABINITIO STUDY OF THE C3BH7 POTENTIAL-ENERGY SURFACE, THE BARRIER TO 1,3-SHIFTS IN ALLYLBORANES, AND NONCLASSICAL BORACYCLOBUTANE, CYCLOPROPYLBORANE, AND VINYLBORANE STRUCTURES (1991) Schleyer P, Clark T Journal article ELECTROSTATIC CATALYSIS OF OXIDATION REACTIONS BY METAL-CATIONS - AN ABINITIO STUDY (1991) Clark T Journal article APPLICATIONS AND EVALUATIONS OF IGLO CHEMICAL-SHIFT CALCULATIONS FOR ORGANOLITHIUM COMPOUNDS (1991) Bühl M, van Eikema Hommes N, Schleyer P, Fleischer U, Kutzelnigg W Journal article DILITHIUM DIPHENYLMETHANEDIIDE - GENERATION, REDOX RELATIONSHIP WITH LITHIUM CHLORODIPHENYLMETHANIDE, IMPLICATION WITH REGARD TO AGGREGATION (1991) van Eikema Hommes N, Bickelhaupt F, Klumpp G Journal article ABINITIO SIMULATION OF ELECTRON-TRANSFER REACTIONS - THE REACTION OF ALKALI-METAL ATOMS WITH ETHYLENE (1991) Hänsele E, Clark T Journal article