ACNP - Italian Periodicals Catalogue

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Results: 1-25 | 26-50 | 51-75 | 76-97

Results: 51-75/97

SI2H2 AND CSIH2 ISOMERS AS LIGANDS IN HIGH-VALENT TRANSITION-METAL COMPLEXES

Authors: STEGMANN R FRENKING G

Citation: R. Stegmann et G. Frenking, SI2H2 AND CSIH2 ISOMERS AS LIGANDS IN HIGH-VALENT TRANSITION-METAL COMPLEXES, Organometallics, 14(11), 1995, pp. 5308-5315

MECHANISM OF THE CHELATION CONTROLLED ADDITION OF CH3TICL3 TO ALPHA-ALKOXY CARBONYL-COMPOUNDS - A THEORETICAL-STUDY

Authors: JONAS V FRENKING G REETZ MT

Citation: V. Jonas et al., MECHANISM OF THE CHELATION CONTROLLED ADDITION OF CH3TICL3 TO ALPHA-ALKOXY CARBONYL-COMPOUNDS - A THEORETICAL-STUDY, Organometallics, 14(11), 1995, pp. 5316-5324

COMPLEXES OF TRANSITION-METALS IN HIGH AND LOW OXIDATION-STATES WITH SIDE-ON-BONDED PI-LIGANDS

Authors: PIDUN U FRENKING G

Citation: U. Pidun et G. Frenking, COMPLEXES OF TRANSITION-METALS IN HIGH AND LOW OXIDATION-STATES WITH SIDE-ON-BONDED PI-LIGANDS, Organometallics, 14(11), 1995, pp. 5325-5336

STRUCTURES AND FOND ENERGIES OF THE TRANSITION-METAL CARBONYLS M(CO)(5) (M=FE, RU, OS) AND M(CO)(4) (M=NI, PD, PT)

Authors: EHLERS AW FRENKING G

Citation: Aw. Ehlers et G. Frenking, STRUCTURES AND FOND ENERGIES OF THE TRANSITION-METAL CARBONYLS M(CO)(5) (M=FE, RU, OS) AND M(CO)(4) (M=NI, PD, PT), Organometallics, 14(1), 1995, pp. 423-426

ANTI VANT HOFF LE BEL GEOMETRIES OF BORON-COMPOUNDS - A THEORETICAL-STUDY OF CLASSICAL AND NONCLASSICAL ISOMERS OF B2CH4, B2NH3 AND B2OH2

Authors: FAU S FRENKING G

Citation: S. Fau et G. Frenking, ANTI VANT HOFF LE BEL GEOMETRIES OF BORON-COMPOUNDS - A THEORETICAL-STUDY OF CLASSICAL AND NONCLASSICAL ISOMERS OF B2CH4, B2NH3 AND B2OH2, Journal of molecular structure. Theochem, 338, 1995, pp. 117-130

INVESTIGATION OF DONOR-ACCEPTOR INTERACTIONS - A CHARGE DECOMPOSITIONANALYSIS USING FRAGMENT MOLECULAR-ORBITALS

Authors: DAPPRICH S FRENKING G

Citation: S. Dapprich et G. Frenking, INVESTIGATION OF DONOR-ACCEPTOR INTERACTIONS - A CHARGE DECOMPOSITIONANALYSIS USING FRAGMENT MOLECULAR-ORBITALS, Journal of physical chemistry, 99(23), 1995, pp. 9352-9362

THE ROLE OF SIGMA-STABILIZATION AND PI-STABILIZATION IN BENZENE, ALLYL CATION AND ALLYL ANION - A CANONICAL ORBITAL ENERGY DERIVATIVE STUDY

Authors: GOBBI A YAMAGUCHI Y FRENKING G SCHAEFER HF

Citation: A. Gobbi et al., THE ROLE OF SIGMA-STABILIZATION AND PI-STABILIZATION IN BENZENE, ALLYL CATION AND ALLYL ANION - A CANONICAL ORBITAL ENERGY DERIVATIVE STUDY, Chemical physics letters, 244(1-2), 1995, pp. 27-31

THE CALCULATION OF BOND-DISSOCIATION ENERGIES OF TRANSITION-METAL COMPLEXES USING ISOSTRUCTURAL REACTIONS

Authors: DAPPRICH S PIDUN U EHLERS AW FRENKING G

Citation: S. Dapprich et al., THE CALCULATION OF BOND-DISSOCIATION ENERGIES OF TRANSITION-METAL COMPLEXES USING ISOSTRUCTURAL REACTIONS, Chemical physics letters, 242(4-5), 1995, pp. 521-526

STRUCTURAL CHARACTERIZATION OF ORGANOCUPRATE REAGENTS - EXAFS SPECTROSCOPY AND AB-INITIO CALCULATIONS

Authors: STEMMLER TL BARNHART TM PENNERHAHN JE TUCKER CE KNOCHEL P BOHME M FRENKING G

Citation: Tl. Stemmler et al., STRUCTURAL CHARACTERIZATION OF ORGANOCUPRATE REAGENTS - EXAFS SPECTROSCOPY AND AB-INITIO CALCULATIONS, Journal of the American Chemical Society, 117(50), 1995, pp. 12489-12497

NMR DATA OF METHYLTITANIUM TRICHLORIDE AND RELATED ORGANOMETALLIC COMPOUNDS - A COMBINED EXPERIMENTAL THEORETICAL-STUDY OF ME(N)XCL(4-N) (N=0-4 X=C, SI, SN, PB, TI)

Authors: BERGER S BOCK W FRENKING G JONAS V MULLER F

Citation: S. Berger et al., NMR DATA OF METHYLTITANIUM TRICHLORIDE AND RELATED ORGANOMETALLIC COMPOUNDS - A COMBINED EXPERIMENTAL THEORETICAL-STUDY OF ME(N)XCL(4-N) (N=0-4 X=C, SI, SN, PB, TI), Journal of the American Chemical Society, 117(13), 1995, pp. 3820-3829

MEAN-LIFETIME CALCULATIONS OF THE METASTABLE DOUBLY-CHARGED NEAR2-GASDIMER( RARE)

Authors: CHEN Z BENITZHAK I LIN CD KOCH W FRENKING G GERTNER I ROSNER B

Citation: Z. Chen et al., MEAN-LIFETIME CALCULATIONS OF THE METASTABLE DOUBLY-CHARGED NEAR2-GASDIMER( RARE), Physical review. A, 49(5), 1994, pp. 3472-3478

NONCLASSICAL STABILIZATION OF PLANAR ALLENES - LOW ROTATIONAL BARRIERS FOR ALLENE DOUBLE-BONDS

Authors: STEINER D WINKLER HJ WOCADLO S FAU S MASSA W FRENKING G BERNDT A

Citation: D. Steiner et al., NONCLASSICAL STABILIZATION OF PLANAR ALLENES - LOW ROTATIONAL BARRIERS FOR ALLENE DOUBLE-BONDS, Angewandte Chemie, International Edition in English, 33(20), 1994, pp. 2064-2067

CANONICAL ORBITAL ENERGY DERIVATIVE STUDIES OF THE C2H2 AND H2CO GROUND-STATE POTENTIAL-ENERGY HYPERSURFACES

Authors: YAMAGUCHI Y REMINGTON RB GAW JF SCHAEFER HF FRENKING G

Citation: Y. Yamaguchi et al., CANONICAL ORBITAL ENERGY DERIVATIVE STUDIES OF THE C2H2 AND H2CO GROUND-STATE POTENTIAL-ENERGY HYPERSURFACES, Chemical physics, 180(1), 1994, pp. 55-70

THEORETICAL-STUDIES OF ORGANOMETALLIC COMPOUNDS .8. STRUCTURES AND BOND-ENERGIES OF THE METHYLCUPRATES CH3CU, (CH3CU-, (CH3)(2)CULI, (CH3)(2)CULI.H2O, [(CH3)(2)CULI](2), AND [(CH3)(2)CULI](2).2H2O

Authors: BOHME M FRENKING G REETZ MT

Citation: M. Bohme et al., THEORETICAL-STUDIES OF ORGANOMETALLIC COMPOUNDS .8. STRUCTURES AND BOND-ENERGIES OF THE METHYLCUPRATES CH3CU, (CH3CU-, (CH3)(2)CULI, (CH3)(2)CULI.H2O, [(CH3)(2)CULI](2), AND [(CH3)(2)CULI](2).2H2O, Organometallics, 13(11), 1994, pp. 4237-4245

STEREOSELECTIVE SYNTHESIS OF BETA-AMINO HYDROXYLAMINES

Authors: REETZ MT ROHRIG D HARMS K FRENKING G

Citation: Mt. Reetz et al., STEREOSELECTIVE SYNTHESIS OF BETA-AMINO HYDROXYLAMINES, Tetrahedron letters, 35(47), 1994, pp. 8765-8768

CONFORMATIONAL-ANALYSIS OF 2-CHLORO-2-FLUOROACETALDEHYDE AND CALCULATED TRANSITION-STATE STRUCTURES OF NUCLEOPHILIC-ADDITION REACTIONS

Authors: FRENKING G KOHLER KF REETZ MT

Citation: G. Frenking et al., CONFORMATIONAL-ANALYSIS OF 2-CHLORO-2-FLUOROACETALDEHYDE AND CALCULATED TRANSITION-STATE STRUCTURES OF NUCLEOPHILIC-ADDITION REACTIONS, Tetrahedron, 50(38), 1994, pp. 11197-11204

THE NATURE OF THE CHEMICAL-BOND IN (CH3)(3)N-BCL3 AND (CH3)(3)N-ALCL3

Authors: JONAS V FRENKING G

Citation: V. Jonas et G. Frenking, THE NATURE OF THE CHEMICAL-BOND IN (CH3)(3)N-BCL3 AND (CH3)(3)N-ALCL3, Naturwissenschaften, 81(7), 1994, pp. 311-313

1ST AND 2ND ENERGY DERIVATIVE ANALYSES FOR OPEN-SHELL SELF-CONSISTENT-FIELD WAVE-FUNCTIONS

Authors: YAMAGUCHI Y SCHAEFER HF FRENKING G

Citation: Y. Yamaguchi et al., 1ST AND 2ND ENERGY DERIVATIVE ANALYSES FOR OPEN-SHELL SELF-CONSISTENT-FIELD WAVE-FUNCTIONS, Molecular physics, 82(4), 1994, pp. 713-733

STUDIES ON THE BORON-NITROGEN BOND-LENGTH OF THE CLASSICAL DONOR-ACCEPTOR COMPLEX H3N-BF3

Authors: JONAS V FRENKING G

Citation: V. Jonas et G. Frenking, STUDIES ON THE BORON-NITROGEN BOND-LENGTH OF THE CLASSICAL DONOR-ACCEPTOR COMPLEX H3N-BF3, Journal of the Chemical Society, Chemical Communications, (12), 1994, pp. 1489-1490

OXO AND NITRIDO COMPLEXES OF MOLYBDENUM, TUNGSTEN, RHENIUM, AND OSMIUM - A THEORETICAL-STUDY

Authors: NEUHAUS A VELDKAMP A FRENKING G

Citation: A. Neuhaus et al., OXO AND NITRIDO COMPLEXES OF MOLYBDENUM, TUNGSTEN, RHENIUM, AND OSMIUM - A THEORETICAL-STUDY, Inorganic chemistry, 33(23), 1994, pp. 5278-5286

STRUCTURES AND BOND-ENERGIES OF THE NOBLE-GAS COMPLEXES NGBEO (NG=AR,KR, XE)

Authors: VELDKAMP A FRENKING G

Citation: A. Veldkamp et G. Frenking, STRUCTURES AND BOND-ENERGIES OF THE NOBLE-GAS COMPLEXES NGBEO (NG=AR,KR, XE), Chemical physics letters, 226(1-2), 1994, pp. 11-16

A SET OF D-POLARIZATION FUNCTIONS FOR PSEUDO-POTENTIAL BASIS-SETS OF THE MAIN-GROUP ELEMENTS AL-BI AND F-TYPE POLARIZATION FUNCTIONS FOR ZN, CD, HG (VOL 208, PG 237, 1993)

Authors: HOLLWARTH A BOHME M DAPPRICH S EHLERS AW GOBBI A JONAS V KOHLER KF STEGMANN R VELDKAMP A FRENKING G

Citation: A. Hollwarth et al., A SET OF D-POLARIZATION FUNCTIONS FOR PSEUDO-POTENTIAL BASIS-SETS OF THE MAIN-GROUP ELEMENTS AL-BI AND F-TYPE POLARIZATION FUNCTIONS FOR ZN, CD, HG (VOL 208, PG 237, 1993), Chemical physics letters, 224(5-6), 1994, pp. 603-603

THE CU-C BOND-DISSOCIATION ENERGY OF CUCH3 - A DRAMATIC FAILURE OF THE QCISD(T) METHOD

Authors: BOHME M FRENKING G

Citation: M. Bohme et G. Frenking, THE CU-C BOND-DISSOCIATION ENERGY OF CUCH3 - A DRAMATIC FAILURE OF THE QCISD(T) METHOD, Chemical physics letters, 224(1-2), 1994, pp. 195-199

THEORETICAL-STUDIES OF ORGANOMETALLIC COMPOUNDS .7. STRUCTURES AND BOND-ENERGIES OF THE TRANSITION-METAL HEXACARBONYLS M(CO)(6) (M=CR, MO, W) - A THEORETICAL-STUDY

Authors: EHLERS AW FRENKING G

Citation: Aw. Ehlers et G. Frenking, THEORETICAL-STUDIES OF ORGANOMETALLIC COMPOUNDS .7. STRUCTURES AND BOND-ENERGIES OF THE TRANSITION-METAL HEXACARBONYLS M(CO)(6) (M=CR, MO, W) - A THEORETICAL-STUDY, Journal of the American Chemical Society, 116(4), 1994, pp. 1514-1520

APPLICATION OF THE ENERGY DERIVATIVE ANALYSIS METHOD TO THE CIS MONOBRIDGED EQUILIBRIUM STRUCTURES AL2H2, SI2H2, GA2H2, AND GE2H2 AND THE COMPARABLE STATIONARY-POINTS OF B2H2 AND C2H2

Authors: YAMAGUCHI Y DELEEUW BJ RICHARDS CA SCHAEFER HF FRENKING G

Citation: Y. Yamaguchi et al., APPLICATION OF THE ENERGY DERIVATIVE ANALYSIS METHOD TO THE CIS MONOBRIDGED EQUILIBRIUM STRUCTURES AL2H2, SI2H2, GA2H2, AND GE2H2 AND THE COMPARABLE STATIONARY-POINTS OF B2H2 AND C2H2, Journal of the American Chemical Society, 116(26), 1994, pp. 11922-11930

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