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Kaupp, Martin (1996) Interpretation of31P-NMR Coordination Shifts for Phosphane Ligands. Ab Initio ECP/DFT Study of Chemical Shift Tensors in M(CO)5L [M = Cr, Mo, W; L = PH3, P(CH3)3, PF3, PCl3]. Chemische Berichte, 129. 535-544 doi:10.1002/cber.19961290510

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Reference TypeJournal (article/letter/editorial)
TitleInterpretation of31P-NMR Coordination Shifts for Phosphane Ligands. Ab Initio ECP/DFT Study of Chemical Shift Tensors in M(CO)5L [M = Cr, Mo, W; L = PH3, P(CH3)3, PF3, PCl3]
JournalChemische Berichte
AuthorsKaupp, MartinAuthor
Year1996 (May)Volume129
PublisherWiley
DOIdoi:10.1002/cber.19961290510Search in ResearchGate
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Mindat Ref. ID4333736Long-form Identifiermindat:1:5:4333736:7
GUID0
Full ReferenceKaupp, Martin (1996) Interpretation of31P-NMR Coordination Shifts for Phosphane Ligands. Ab Initio ECP/DFT Study of Chemical Shift Tensors in M(CO)5L [M = Cr, Mo, W; L = PH3, P(CH3)3, PF3, PCl3]. Chemische Berichte, 129. 535-544 doi:10.1002/cber.19961290510
Plain TextKaupp, Martin (1996) Interpretation of31P-NMR Coordination Shifts for Phosphane Ligands. Ab Initio ECP/DFT Study of Chemical Shift Tensors in M(CO)5L [M = Cr, Mo, W; L = PH3, P(CH3)3, PF3, PCl3]. Chemische Berichte, 129. 535-544 doi:10.1002/cber.19961290510
In(1996) Chemische Berichte Vol. 129. Wiley

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Kaupp, Martin, Malkin, Vladimir G., Malkina, Olga L., Salahub, Dennis R. (1996) Ab Initio ECP/DFT Calculation and Interpretation of Carbon and Oxygen NMR Chemical Shift Tensors in Transition-Metal Carbonyl Complexes. Chemistry - A European Journal, 2 (1). 24-30 doi:10.1002/chem.19960020108
Kaupp, Martin (1996) NMR Chemical-Shift Anomaly and Bonding in Piano-Stool Carbonyl and Related Complexes–an Ab Initio ECP/DFT Study. Chemistry - A European Journal, 2 (3). 348-358 doi:10.1002/chem.19960020317
Kaupp, Martin (1996) Analysis of13C and17O Chemical Shift Tensors and an ELF View of Bonding in Fe2(CO)9 and Rh6(CO)16. Chemische Berichte, 129. 527-533 doi:10.1002/cber.19961290509
Kaupp, Martin, Malkin, Vladimir G., Malkina, Olga L., Salahub, Dennis R. (1995) Scalar Relativistic Effects on 17O NMR Chemical Shifts in Transition-Metal Oxo Complexes. An ab Initio ECP/DFT Study. Journal Of The American Chemical Society, 117 (6) 1851-1852 doi:10.1021/ja00111a032
Kaupp, Martin, Malkin, Vladimir G., Malkina, Olga L., Salahub, Dennis R. (1995) Scalar Relativistic Effects on 17O NMR Chemical Shifts in Transition-Metal Oxo Complexes. An ab Initio ECP/DFT Study. [Erratum to document cited in CA122:254385]. Journal Of The American Chemical Society, 117 (32) 8492 doi:10.1021/ja00137a036
Adams, Richard D., Falloon, Stephen B., Perrin, Joseph L., Queisser, Joachim A., Yamamoto, John H. (1996) The Catalytic Ring-opening Cyclooligomerization (ROC) of Thietane by the Complexes M(CO)5L (M  Cr and W; L = CO, thietane and 1,5,9-Trithiacyclododecane). Chemische Berichte, 129. 313-318 doi:10.1002/cber.19961290311
Drieß, Matthias, Pritzkow, Hans, Reisgys, Michael (1996) Synthesen und Strukturen von neuen 1,3,5-Triphospha-2,4,6-trisilacyclohexanen und Untersuchung ihrer Ligandeneigenschaften gegenüber [M(CO)3]-Komplexfragmenten (M = Cr, Mo). Chemische Berichte, 129. 247-252 doi:10.1002/cber.19961290222
Paul, Martin, Schmidbaur, Hubert (1996) Coordination Chemistry of Dimethylgold Halides with Bidentate Phosphorus and Arsenic Ligands – Revisited. Chemische Berichte, 129. 77-83 doi:10.1002/cber.19961290116
Ruiz-Morales, Yosadara, Ziegler, Tom (1998) A Theoretical Study of31P and95Mo NMR Chemical Shifts in M(CO)5PR3(M = Cr, Mo; R = H, CH3, C6H5, F, and Cl) Based on Density Functional Theory and Gauge-Including Atomic Orbitals. The Journal of Physical Chemistry A, 102 (22). 3970-3976 doi:10.1021/jp973308u
Mebel, Alexander M., Musaev, Djamaladdin G., Morokuma, Keiji (1993) Ab initio molecular orbital study of structure and NMR 11B chemical shifts of Lewis base adducts of CO, NH3, PF3, and PH3 with small nido-boranes, B3H7 and B4H8. Chemical Physics Letters, 214. 69-76 doi:10.1016/0009-2614(93)85457-y
Börner, Michael, Vahrenkamp, Heinrich (1978) Metallorganische Lewis-Basen, XXXVII: Darstellung und Reaktionen der Metall-Metall-verknüpften Zweikernkomplexe (CO)5M[μ-As(CH3)2]M′(CO)2C2H5 (M, M′  Cr, Mo, W). Chemische Berichte, 111. 2190-2198 doi:10.1002/cber.19781110615
 
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