화학공학소재연구정보센터
검색결과 : 20건
No. Article
1 Ab initio methods for the calculation of NMR shielding and indirect spin-spin coupling constants
Helgaker T, Jaszunski M, Ruud K
Chemical Reviews, 99(1), 293, 1999
2 Structure and nonrigidity of B9H92- and B9H10-. Comparisons of BnHn2- and BnHn+1- systems
Mebel AM, Schleyer PV, Najafian K, Charkin OP
Inorganic Chemistry, 37(8), 1693, 1998
3 Stability and three-dimensional aromaticity of closo-monocarbaborane anions, CBn-1Hn-, and closo-dicarboranes, C2Bn-2Hn
Schleyer PV, Najafian K
Inorganic Chemistry, 37(14), 3454, 1998
4 Structures of arachno- and hypho-B-10 clusters and stability of their possible Lewis base adducts ([B10H12](2-), [B10H12 center dot L](2-), [B10H12 center dot 2L](2-), [B10H13](-), [B10H13 center dot L](-), [B10H12 center dot 2L]). An ab initio IGLO NMR investigation
Hofmann M, Schleyer PV
Inorganic Chemistry, 37(21), 5557, 1998
5 Ab initio calculations of the C-13 NMR spectrum of 2-propyl cations in ion pairs
Farcasiu D, Hancu D, Haw JF
Journal of Physical Chemistry A, 102(14), 2493, 1998
6 Benzenium Ion Chemistry on Solid Metal Halide Superacids - In-Situ C-13 NMR Experiments and Theoretical Calculations
Xu T, Barich DH, Torres PD, Haw JF
Journal of the American Chemical Society, 119(2), 406, 1997
7 A Solid-State (NMR)-N-1 and Theoretical-Study of the Chemical Bonding in Disilenes
West R, Cavalieri JD, Buffy JJ, Fry C, Zilm KW, Duchamp JC, Kira M, Iwamoto T, Muller T, Apeloig Y
Journal of the American Chemical Society, 119(21), 4972, 1997
8 Interaction of Trimethylamine and Closo-1,6-C2B7H9 - Evidence for an Open Cage C2B7H9/Amine Adduct
Diaz M, Jaballas J, Tran D, Lee H, Arias J, Onak T
Inorganic Chemistry, 35(16), 4536, 1996
9 A Comparison of Models for Calculating Nuclear-Magnetic-Resonance Shielding Tensors
Cheeseman JR, Trucks GW, Keith TA, Frisch MJ
Journal of Chemical Physics, 104(14), 5497, 1996
10 Natural Bond Orbital Analysis of C-13 Chemical Shieldings in Acetylenes
Bohmann J, Farrar TC
Journal of Physical Chemistry, 100(7), 2646, 1996