IGLO Calculations of NMR Chemical Shifts in Some Silicon and Phosphorus Containing Polycycles
作者： U. Fleischer , C. Van Wüllen , W. Kutzelnigg
DOI: 10.1080/10426509408021859
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摘要: Abstract NMR is one of the spectroscopies most widely used by chemists. The dependence chemical shifts on local (electronic) structure make them a powerful tool for identification compounds as well elucidation. Additionally can be taken probe electronic in neighbourhood nucleus studied. More information gained if not only isotropic values (or nuclear magnetic shieldings) but full tensors (i.e. principal and orientation axes system) are available.
sci-hub.se 参考文章(9)
G. Heckmann, E. Fluck, 31P nuclear magnetic resonance chemical shifts of elemental phosphorus in the gas phase Molecular Physics. ,vol. 23, pp. 175- 183 ,(1972) , 10.1080/00268977200100151
Thomas Wettling, Jürgen Schneider, Oliver Wagner, Cornelius G. Kreiter, Manfred Regitz, Tetra‐tert‐butyl‐tetraphosphacuban–die erste thermische Cyclooligomerisierung eines Phosphaalkins Angewandte Chemie. ,vol. 101, pp. 1035- 1037 ,(2006) , 10.1002/ANGE.19891010808
Michael Schindler, Werner Kutzelnigg, Theory of magnetic susceptibilities and NMR chemical shifts in terms of localized quantities. II. Application to some simple molecules Journal of Chemical Physics. ,vol. 76, pp. 1919- 1933 ,(1982) , 10.1063/1.443165
Marianne Baudler, Guido Scholz, Karl-Friedrich Tebbe, Magda Fehér, (tBuSiP)4 – das erste Silaphosphacuban Angewandte Chemie. ,vol. 101, pp. 352- 354 ,(1989) , 10.1002/ANGE.19891010329
Nils Wiberg, Christian M. M. Finger, Kurt Polborn, Tetrakis(tri-tert-butylsilyl)-tetrahedro-tetrasilan (tBu3Si)4Si4 — die erste molekulare Siliciumverbindung mit einem Si4-Tetraeder Angewandte Chemie. ,vol. 105, pp. 1140- 1142 ,(1993) , 10.1002/ANGE.19931050744
Akira Sekiguchi, Tetsuo Yatabe, Chizuko Kabuto, Hideki Sakurai, Chemistry of organosilicon compounds. 303. The missing hexasilaprismane: synthesis, x-ray analysis and photochemical reactions Journal of the American Chemical Society. ,vol. 115, pp. 5853- 5854 ,(1993) , 10.1021/JA00066A075
Akira Sekiguchi, Tetsuo Yatabe, Hirokazu Kamatani, Chizuko Kabuto, Hideki Sakurai, Chemistry of organosilicon compounds. 293. Preparation, characterization, and crystal structures of octasilacubanes and octagermacubanes Journal of the American Chemical Society. ,vol. 114, pp. 6260- 6262 ,(1992) , 10.1021/JA00041A063
Julio C. Facelli, David M. Grant, Molecular Structure and Carbon‐13 Chemical Shielding Tensors Obtained from Nuclear Magnetic Resonance Topics in Stereochemistry. ,vol. 19, pp. 1- 61 ,(2007) , 10.1002/9780470147283.CH1
U. Fleischer, W. Kutzelnigg, IGLO Calculations of Phosphorus NMR Chemical Shifts Phosphorus Sulfur and Silicon and The Related Elements. ,vol. 77, pp. 105- 108 ,(1993) , 10.1080/10426509308045630