-
2
-
-
85005543135
-
-
For a review see: D. Cremer, L. Olsson, F. Reichel and E. Kraka, Isr. J. Chew., 1993, 33, 369.
-
(1993)
Isr. J. Chew.
, vol.33
, pp. 369
-
-
Cremer, D.1
Olsson, L.2
Reichel, F.3
Kraka, E.4
-
5
-
-
11744305193
-
-
(c) K. Wolinski, J. F. Hinton and P. Pulay, J. Am. Chem. Soc., 1990, 122, 8251.
-
(1990)
J. Am. Chem. Soc.
, vol.122
, pp. 8251
-
-
Wolinski, K.1
Hinton, J.F.2
Pulay, P.3
-
10
-
-
0004165142
-
-
Springer, Berlin
-
(e) W. Kutzelnigg and M. Schindler, NMR, Basic Principles and Progress, Springer, Berlin, 1989, Vol. 23;
-
(1989)
NMR, Basic Principles and Progress
, vol.23
-
-
Kutzelnigg, W.1
Schindler, M.2
-
13
-
-
0347826849
-
-
See ref. 2 and references cited therein
-
See ref. 2 and references cited therein.
-
-
-
-
14
-
-
0030121844
-
-
G. Rauhut, S. Puyear, K. Wolinski and P. Pulay, J. Phys. Chem., 1996, 100, 6310.
-
(1996)
J. Phys. Chem.
, vol.100
, pp. 6310
-
-
Rauhut, G.1
Puyear, S.2
Wolinski, K.3
Pulay, P.4
-
15
-
-
84873055189
-
-
Wiley, New York
-
W. J. Hehre, L. Radom, P. v. R. Schleyer and J. A. Pople, Ab Initio Molecular Orbital Theory, Wiley, New York, 1986.
-
(1986)
Ab Initio Molecular Orbital Theory
-
-
Hehre, W.J.1
Radom, L.2
Schleyer, P.V.R.3
Pople, J.A.4
-
16
-
-
0004133516
-
-
Gaussian Inc., Pittsburgh PA
-
M. J. Frisch, G. W. Trucks, H. B. Schlegel, P. M. W. Gill, B. G. Johnson, M. A. Robb, J. R. Cheeseman, T. A. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavachari, M. A. Al-Laham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, J. Cioslowski, B. B. Stefanov, A. Nanayakkara, M. Challacombe, C. Y. Peng, P. Y. Ayala, W. Chen, M. W. Wong, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. DeFrees, J. Baker, J. J. P. Stewart, M. Head-Gordon, C. Gonzalez and J. A. Pople, GAUSSIAN 94; Gaussian Inc., Pittsburgh PA, 1995.
-
(1995)
GAUSSIAN 94
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Gill, P.M.W.4
Johnson, B.G.5
Robb, M.A.6
Cheeseman, J.R.7
Keith, T.A.8
Petersson, G.A.9
Montgomery, J.A.10
Raghavachari, K.11
Al-Laham, M.A.12
Zakrzewski, V.G.13
Ortiz, J.V.14
Foresman, J.B.15
Cioslowski, J.16
Stefanov, B.B.17
Nanayakkara, A.18
Challacombe, M.19
Peng, C.Y.20
Ayala, P.Y.21
Chen, W.22
Wong, M.W.23
Andres, J.L.24
Replogle, E.S.25
Gomperts, R.26
Martin, R.L.27
Fox, D.J.28
Binkley, J.S.29
DeFrees, D.J.30
Baker, J.31
Stewart, J.J.P.32
Head-Gordon, M.33
Gonzalez, C.34
Pople, J.A.35
more..
-
18
-
-
0347196693
-
-
Cray Research, Inc., Mendota Heights MN, USA
-
UniChem 3.01: Cray Research, Inc., Mendota Heights MN, USA, 1995. DGauss 3.0: J. Andzelm and E. Wimmer, Oxford Molecular Group, Burnsville MN, USA, 1995.
-
(1995)
UniChem 3.01
-
-
-
19
-
-
0346566586
-
-
Oxford Molecular Group, Burnsville MN, USA
-
UniChem 3.01: Cray Research, Inc., Mendota Heights MN, USA, 1995. DGauss 3.0: J. Andzelm and E. Wimmer, Oxford Molecular Group, Burnsville MN, USA, 1995.
-
(1995)
DGauss 3.0
-
-
Andzelm, J.1
Wimmer, E.2
-
20
-
-
0038619345
-
-
personal communication
-
H. Jiao and P. v. R. Schleyer, personal communication; see also M. Bühl and P. v. R. Schleyer, J. Am. Chem. Soc., 1992, 114, 477.
-
-
-
Jiao, H.1
Schleyer, P.V.R.2
-
23
-
-
33748968516
-
-
D. Hamprecht, K. Polborn and W. Steglich, Angew. Chem., Int. Ed. Engl., 1995, 34, 1469.
-
(1995)
Angew. Chem., Int. Ed. Engl.
, vol.34
, pp. 1469
-
-
Hamprecht, D.1
Polborn, K.2
Steglich, W.3
-
24
-
-
84985616494
-
-
E. Vogel, H.-J. Altenbach, J.-M. Drossard, H. Schmickler and H. Stegelmeier, Angew. Chem., Int. Ed. Engl., 1980, 19, 1016.
-
(1980)
Angew. Chem., Int. Ed. Engl.
, vol.19
, pp. 1016
-
-
Vogel, E.1
Altenbach, H.-J.2
Drossard, J.-M.3
Schmickler, H.4
Stegelmeier, H.5
-
25
-
-
0030581367
-
-
D. Hamprecht, J. Josten and W. Steglich, Tetrahedron, 1996, 52, 10883.
-
(1996)
Tetrahedron
, vol.52
, pp. 10883
-
-
Hamprecht, D.1
Josten, J.2
Steglich, W.3
-
26
-
-
0347826848
-
-
The relative carbon chemical shifts vary by only ca. 1-2 ppm
-
The relative carbon chemical shifts vary by only ca. 1-2 ppm.
-
-
-
-
27
-
-
85087250701
-
-
note
-
* level.
-
-
-
|