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There are 8199 results for: content related to: New Acyclic Neutral Phosphorus Sulfides and Sulfide Oxides

  1. Comparison of different theory models and basis sets in the calculation of 13C NMR chemical shifts of natural products

    Magnetic Resonance in Chemistry

    Volume 42, Issue S1, October 2004, Pages: S26–S33, Paola Cimino, Luigi Gomez-Paloma, Dario Duca, Raffaele Riccio and Giuseppe Bifulco

    Version of Record online : 26 AUG 2004, DOI: 10.1002/mrc.1410

  2. Density functional theory and ab initio study on the reaction mechanisms of the homogeneous, unimolecular elimination kinetics of selected 1-chloroalkenes in the gas phase

    International Journal of Quantum Chemistry

    Volume 112, Issue 24, 15 December 2012, Pages: 3729–3738, Jose R. Mora, Jesus Lezama, Neydher Berroteran, Tania Cordova and Gabriel Chuchani

    Version of Record online : 24 MAY 2012, DOI: 10.1002/qua.24175

  3. The Role of Noninnocent Solvent Molecules in Organocatalyzed Asymmetric Michael Addition Reactions

    Chemistry - A European Journal

    Volume 14, Issue 33, November 17, 2008, Pages: 10472–10485, Mahendra P. Patil and Raghavan B. Sunoj

    Version of Record online : 1 OCT 2008, DOI: 10.1002/chem.200800877

  4. Density functional theory study of 13C NMR chemical shift of chlorinated compounds

    Magnetic Resonance in Chemistry

    Volume 50, Issue 2, February 2012, Pages: 106–113, Songqing Li, Wenfeng Zhou, Haixiang Gao and Zhiqiang Zhou

    Version of Record online : 21 FEB 2012, DOI: 10.1002/mrc.2837

  5. Theoretical calculations on the mechanisms of the gas-phase elimination kinetics of 2-chloro-1-phenylethane, 3-chloro-1-phenylpropane, 4-chloro-1-phenylbutane, 5-chloro-1-phenylpentane, and their corresponding chloroalkanes: The effect of the phenyl ring

    International Journal of Chemical Kinetics

    Volume 43, Issue 6, June 2011, Pages: 292–302, Alexis Maldonado, Jose R. Mora, Simon J. Subero, Marcos Loroño, Tania Cordova and Gabriel Chuchani

    Version of Record online : 25 APR 2011, DOI: 10.1002/kin.20548

  6. Edge-Bridging and Face-Bridging Hydrogen Atoms in Trinuclear Rhenium Carbonyl Hydrides

    European Journal of Inorganic Chemistry

    Volume 2011, Issue 29, October 2011, Pages: 4626–4636, Nan Li, Yaoming Xie, R. Bruce King and Henry F. Schaefer III

    Version of Record online : 6 SEP 2011, DOI: 10.1002/ejic.201100476

  7. Heptahapticity in Binuclear (Cycloheptatrienyl)molybdenum Carbonyl Derivatives: The Interplay between Ring Hapticity/Planarity and Metal–Metal Multiple Bonding

    Chemistry – An Asian Journal

    Volume 5, Issue 5, May 3, 2010, Pages: 1192–1201, Xuejun Feng, Chanyuan Xie, Yaoming Xie, R. Bruce King and Henry F. Schaefer III

    Version of Record online : 12 APR 2010, DOI: 10.1002/asia.200900363

  8. The interplay between metal–metal bonds, four-electron donor carbonyl groups, and five-electron donor nitrosyl groups in highly unsaturated binuclear rhenium carbonyl nitrosyls

    International Journal of Quantum Chemistry

    Volume 109, Issue 10, 2009, Pages: 2273–2285, Bing Xu, Qian-Shu Li, Yaoming Xie, R. Bruce King and Henry F. Schaefer III

    Version of Record online : 31 MAR 2009, DOI: 10.1002/qua.22171

  9. Prediction of tautomeric preferences and pKa values for oxyluciferin and its constituent heterocycles

    Journal of Physical Organic Chemistry

    Volume 16, Issue 6, June 2003, Pages: 336–347, Erin E. Dahlke and Christopher J. Cramer

    Version of Record online : 15 MAY 2003, DOI: 10.1002/poc.634

  10. Inhibition of Alkyne Cyclotrimerization to Arenes on a Metal Site by Four-Electron Donation through Simultaneous Sigma and Pi Bonding: The Tris(alkyne)Tungsten Carbonyls

    European Journal of Inorganic Chemistry

    Volume 2009, Issue 35, December 2009, Pages: 5439–5448, Bin Peng, Qian-Shu Li, Yaoming Xie, R. Bruce King and Henry F. Schaefer III

    Version of Record online : 5 NOV 2009, DOI: 10.1002/ejic.200900827

  11. Interactions of Atomic Iron Cation with Pyridine and Benzene: A Theoretical Study on an Unresolved Controversy of Bond Energies and Electronic Ground-State Structures

    Helvetica Chimica Acta

    Volume 86, Issue 4, April 2003, Pages: 1008–1025, Martin Diefenbach, Claudia Trage and Helmut Schwarz

    Version of Record online : 29 APR 2003, DOI: 10.1002/hlca.200390090

  12. Kinetics and structural aspects of the cisplatin interactions with guanine: A quantum mechanical description

    International Journal of Quantum Chemistry

    Volume 106, Issue 9, 2006, Pages: 2129–2144, Luiz Antônio S. Costa, Trevor W. Hambley, Willian R. Rocha, Wagner B. De Almeida and Hélio F. Dos Santos

    Version of Record online : 13 MAR 2006, DOI: 10.1002/qua.20979

  13. Density functional theory studies on the addition and abstraction reactions of OH radicals with terephthalate dianions

    International Journal of Quantum Chemistry

    Volume 113, Issue 4, 15 February 2013, Pages: 418–422, Nobuaki Tanaka, Shigeo Itoh and Hiromasa Nishikiori

    Version of Record online : 13 FEB 2012, DOI: 10.1002/qua.24022

  14. GIAO/DFT evaluation of 13C NMR chemical shifts of selected acetals based on DFT optimized geometries

    Magnetic Resonance in Chemistry

    Volume 42, Issue 5, May 2004, Pages: 459–466, Wojciech Migda and Barbara Rys

    Version of Record online : 18 FEB 2004, DOI: 10.1002/mrc.1366

  15. Synthesis and Crystal Structure of the Bis(ethoxo)tetrathio-μ-disulfido-diphosphate Salt: [pyH]2[P2S6(OEt)2]

    Zeitschrift für anorganische und allgemeine Chemie

    Volume 640, Issue 5, April 2014, Pages: 898–901, Stefanie Schönberger, Sinah Krönauer, Thomas M. Klapötke and Konstantin Karaghiosoff

    Version of Record online : 15 JAN 2014, DOI: 10.1002/zaac.201300420

  16. The highly unsaturated dimetal hexacarbonyls of manganese and rhenium: Alternatives to a formal metal–metal quintuple bond

    International Journal of Quantum Chemistry

    Volume 109, Issue 13, 5 November 2009, Pages: 3082–3092, Bing Xu, Qian-Shu Li, Yaoming Xie, R. Bruce King and Henry F. Schaefer III

    Version of Record online : 30 APR 2009, DOI: 10.1002/qua.22150

  17. The Facile Preparation of Weakly Coordinating Anions: Structure and Characterisation of Silverpolyfluoroalkoxyaluminates AgAl(ORF)4, Calculation of the Alkoxide Ion Affinity

    Chemistry - A European Journal

    Volume 7, Issue 2, January 19, 2001, Pages: 490–502, Ingo Krossing

    Version of Record online : 16 JAN 2001, DOI: 10.1002/1521-3765(20010119)7:2<490::AID-CHEM490>3.0.CO;2-I

  18. Origin of the SN2 Benzylic Effect: Contributions by π Delocalization and Field/Inductive Effects

    European Journal of Organic Chemistry

    Volume 2012, Issue 30, October 2012, Pages: 5991–6004, Robert E. Rawlings, Adam K. McKerlie, Daniel J. Bates, Yirong Mo and Joel M. Karty

    Version of Record online : 17 SEP 2012, DOI: 10.1002/ejoc.201200880

  19. Theoretical calculations of the kinetics and mechanisms of the gas phase elimination of primary, secondary, and tertiary 2-hydroxyalkylbenzenes

    Journal of Physical Organic Chemistry

    Volume 22, Issue 12, December 2009, Pages: 1198–1207, Jose R. Mora, Jesus Lezama, José M. Albornoz, Antonio Hernandez, Tania Córdova and Gabriel Chuchani

    Version of Record online : 29 JUN 2009, DOI: 10.1002/poc.1577

  20. On the Relative Preference of Enamine/Iminium Pathways in an Organocatalytic Michael Addition Reaction

    Chemistry – An Asian Journal

    Volume 4, Issue 5, May 4, 2009, Pages: 714–724, Mahendra P. Patil and Raghavan B. Sunoj

    Version of Record online : 7 APR 2009, DOI: 10.1002/asia.200800351