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Results: 1-19 |
Results: 19
AROMATICITY AND ANTIAROMATICITY IN OLIGOCYCLIC ANNELATED 5-MEMBERED RING-SYSTEMS
Authors: ZYWIETZ TK JIAO HJ SCHLEYER PVR DEMEIJERE A
Citation: Tk. Zywietz et al., AROMATICITY AND ANTIAROMATICITY IN OLIGOCYCLIC ANNELATED 5-MEMBERED RING-SYSTEMS, Journal of organic chemistry, 63(10), 1998, pp. 3417-3422
METHYLZINC TETRAHYDROBORATE - INVESTIGATION OF THE VAPOR-PHASE BY SPECTROSCOPIC AND QUANTUM-CHEMICAL TECHNIQUES
Authors: ALDRIDGE S DOWNS AJ HOFMANN M PULHAM CR SCHLEYER PVR
Citation: S. Aldridge et al., METHYLZINC TETRAHYDROBORATE - INVESTIGATION OF THE VAPOR-PHASE BY SPECTROSCOPIC AND QUANTUM-CHEMICAL TECHNIQUES, Journal of molecular structure, 444(1-3), 1998, pp. 29-46
[3(6)](1,2,3,4,5,6)CYCLOPHANE - A MOLECULAR PINWHEEL AND ITS CORRELATED INVERSION - NMR AND ENERGETIC CONSIDERATIONS
Authors: BETTINGER HF SCHLEYER PVR SCHAEFER HF
Citation: Hf. Bettinger et al., [3(6)](1,2,3,4,5,6)CYCLOPHANE - A MOLECULAR PINWHEEL AND ITS CORRELATED INVERSION - NMR AND ENERGETIC CONSIDERATIONS, Journal of the American Chemical Society, 120(5), 1998, pp. 1074-1075
A 5-ATOM MOLECULE WHICH ENANTIOMERIZES IN A SINGLE-STEP VIA CHIRAL TRANSITION-STATES
Authors: MAUKSCH M SCHLEYER PVR
Citation: M. Mauksch et Pvr. Schleyer, A 5-ATOM MOLECULE WHICH ENANTIOMERIZES IN A SINGLE-STEP VIA CHIRAL TRANSITION-STATES, Angewandte Chemie, International Edition in English, 36(17), 1997, pp. 1856-1860
LITHIO-AVERSION OF THIOPHENE SULFUR-ATOMS IN THE X-RAY CRYSTAL-STRUCTURES OF [LI-O-SIME2(2-C4H3S)](6) AND [LI-O-CH(I-PR)(2-C4H3S)(])6 - MODELS FOR ELECTROSTATIC METAL-THIOPHENE INTERACTIONS
Authors: GOLDFUSS B SCHLEYER PVR HAMPEL F
Citation: B. Goldfuss et al., LITHIO-AVERSION OF THIOPHENE SULFUR-ATOMS IN THE X-RAY CRYSTAL-STRUCTURES OF [LI-O-SIME2(2-C4H3S)](6) AND [LI-O-CH(I-PR)(2-C4H3S)(])6 - MODELS FOR ELECTROSTATIC METAL-THIOPHENE INTERACTIONS, Organometallics, 16(23), 1997, pp. 5032-5041
EMPIRICAL FORCE-FIELD AND AB-INITIO CALCULATIONS ON ALLYL CATIONS
Authors: REINDL B CLARK T SCHLEYER PVR
Citation: B. Reindl et al., EMPIRICAL FORCE-FIELD AND AB-INITIO CALCULATIONS ON ALLYL CATIONS, Journal of computational chemistry, 18(4), 1997, pp. 533-551
AB-INITIO STUDY OF ISOMERISM IN SALT MOLE CULES LIAB WITH 10 AND 12 VALENCE-ELECTRONS
Authors: CHARKIN OP MCKEE ML SCHLEYER PVR
Citation: Op. Charkin et al., AB-INITIO STUDY OF ISOMERISM IN SALT MOLE CULES LIAB WITH 10 AND 12 VALENCE-ELECTRONS, Zurnal neorganiceskoj himii, 42(8), 1997, pp. 1332-1343
AB-INITIO STUDY OF ISOMERISM AND REARRANG EMENTS IN SALT MOLECULES LIAB WITH 12 AND 14 VALENCE-ELECTRONS
Authors: CHARKIN OP MCKEE ML SCHLEYER PVR
Citation: Op. Charkin et al., AB-INITIO STUDY OF ISOMERISM AND REARRANG EMENTS IN SALT MOLECULES LIAB WITH 12 AND 14 VALENCE-ELECTRONS, Zurnal neorganiceskoj himii, 42(8), 1997, pp. 1344-1348
WHY THE CLASSICAL AND NONCLASSICAL NORBORNYL CATIONS DO NOT RESEMBLE THE 2-ENDO-NORBORNYL AND 2-EXO-NORBORNYL SOLVOLYSIS TRANSITION-STATES
Authors: SCHREINER PR SCHLEYER PVR SCHAEFER HF
Citation: Pr. Schreiner et al., WHY THE CLASSICAL AND NONCLASSICAL NORBORNYL CATIONS DO NOT RESEMBLE THE 2-ENDO-NORBORNYL AND 2-EXO-NORBORNYL SOLVOLYSIS TRANSITION-STATES, Journal of organic chemistry, 62(13), 1997, pp. 4216-4228
AB-INITIO CALCULATIONS SHOW HOW P-31 NMR CHEMICAL-SHIFTS IN PXYZ PHOSPHINES CORRELATE WITH SUBSTITUENT ELECTRONEGATIVITY
Authors: DRANSFELD A SCHLEYER PVR
Citation: A. Dransfeld et Pvr. Schleyer, AB-INITIO CALCULATIONS SHOW HOW P-31 NMR CHEMICAL-SHIFTS IN PXYZ PHOSPHINES CORRELATE WITH SUBSTITUENT ELECTRONEGATIVITY, Phosphorus, sulfur and silicon and the related elements, 111(1-4), 1996, pp. 675-675
9-BORABARBARALANES
Authors: HERBERICH GE MARX HW MOSS S SCHLEYER PVR WAGNER T
Citation: Ge. Herberich et al., 9-BORABARBARALANES, Chemistry, 2(4), 1996, pp. 458-461
MOLECULAR MECHANICS .2.
Authors: ALLINGER NL SCHLEYER PVR
Citation: Nl. Allinger et Pvr. Schleyer, MOLECULAR MECHANICS .2., Journal of computational chemistry, 17(5-6), 1996, pp. 489-489
COMPUTATIONAL EVIDENCE FOR THE EXISTENCE OF CU INTERMEDIATES IN ADDITION AND SUBSTITUTION-REACTIONS WITH DIALKYLCUPRATES
Authors: DORIGO AE WANNER J SCHLEYER PVR
Citation: Ae. Dorigo et al., COMPUTATIONAL EVIDENCE FOR THE EXISTENCE OF CU INTERMEDIATES IN ADDITION AND SUBSTITUTION-REACTIONS WITH DIALKYLCUPRATES, Angewandte Chemie, International Edition in English, 34(4), 1995, pp. 476-478
ALPHA-ETHOXYVINYLLITHIUM - AN UNEXPECTED POLYMERIC STRUCTURE TETRAMERIC SUBUNITS LINKED BY LI-C PI-INTERACTIONS
Authors: SORGER K BAUER W SCHLEYER PVR STALKE D
Citation: K. Sorger et al., ALPHA-ETHOXYVINYLLITHIUM - AN UNEXPECTED POLYMERIC STRUCTURE TETRAMERIC SUBUNITS LINKED BY LI-C PI-INTERACTIONS, Angewandte Chemie, International Edition in English, 34(15), 1995, pp. 1594-1596
AB-INITIO PREDICTION OF THE STRUCTURE, HARMONIC VIBRATIONAL FREQUENCIES, AND DISSOCIATION-ENERGY OF THE H-2-GEH3-H-2 CLUSTER ION()
Authors: ARCHIBONG EF SCHREINER PF LESZCZYNSKI J SCHLEYER PVR SCHAEFER HF SULLIVAN R
Citation: Ef. Archibong et al., AB-INITIO PREDICTION OF THE STRUCTURE, HARMONIC VIBRATIONAL FREQUENCIES, AND DISSOCIATION-ENERGY OF THE H-2-GEH3-H-2 CLUSTER ION(), The Journal of chemical physics, 102(9), 1995, pp. 3667-3673
THEORETICAL AB-INITIO STUDY OF NEUTRAL AND CHARGED B3HN (N=3-9) SPECIES - IMPORTANCE OF AROMATICITY IN DETERMINING THE STRUCTURAL PREFERENCES
Authors: KORKIN AA SCHLEYER PVR MCKEE ML
Citation: Aa. Korkin et al., THEORETICAL AB-INITIO STUDY OF NEUTRAL AND CHARGED B3HN (N=3-9) SPECIES - IMPORTANCE OF AROMATICITY IN DETERMINING THE STRUCTURAL PREFERENCES, Inorganic chemistry, 34(4), 1995, pp. 961-977
INFLUENCE OF THE NONPLANARITY OF THE AMIDE MOIETY ON COMPUTED CHEMICAL-SHIFTS IN PEPTIDE ANALOGS - IS THE AMIDE NITROGEN PYRAMIDAL
Authors: SULZBACH HM SCHLEYER PVR SCHAEFER HF
Citation: Hm. Sulzbach et al., INFLUENCE OF THE NONPLANARITY OF THE AMIDE MOIETY ON COMPUTED CHEMICAL-SHIFTS IN PEPTIDE ANALOGS - IS THE AMIDE NITROGEN PYRAMIDAL, Journal of the American Chemical Society, 117(9), 1995, pp. 2632-2637
WHAT IS THE PREFERRED STRUCTURE OF THE SINGLET CYCLOPENTADIENYL CATION
Authors: GLUKHOVTSEV MN REINDL B SCHLEYER PVR
Citation: Mn. Glukhovtsev et al., WHAT IS THE PREFERRED STRUCTURE OF THE SINGLET CYCLOPENTADIENYL CATION, Mendeleev communications, (3), 1993, pp. 100-102
A COMBINED NMR IGLO ABINITIO STUDY OF THE C2B10H13-ISOMERS
Authors: MCKEE ML BUHL M SCHLEYER PVR
Citation: Ml. Mckee et al., A COMBINED NMR IGLO ABINITIO STUDY OF THE C2B10H13-ISOMERS, Inorganic chemistry, 32(9), 1993, pp. 1712-1715
Risultati: 1-19 |