-
1
-
-
0035353481
-
-
and other articles in that special issue
-
Schleyer, P. v. R. Chem. Rev. 2001, 101, 1115-1118 and other articles in that special issue.
-
(2001)
Chem. Rev.
, vol.101
, pp. 1115-1118
-
-
Schleyer, P.V.R.1
-
3
-
-
0343362681
-
-
Krygowski, T. M.; Cyranski, M. K.; Hafelinger, G.; Katritzky, A. R. Tetrahedron 2000, 56, 1783-1796.
-
(2000)
Tetrahedron
, vol.56
, pp. 1783-1796
-
-
Krygowski, T.M.1
Cyranski, M.K.2
Hafelinger, G.3
Katritzky, A.R.4
-
12
-
-
33947315480
-
-
Dauben, H. J. J.; Wilson, D. J.; Laity, J. L. J. Am. Chem. Soc. 1968, 90, 811-813.
-
(1968)
J. Am. Chem. Soc.
, vol.90
, pp. 811-813
-
-
Dauben, H.J.J.1
Wilson, D.J.2
Laity, J.L.3
-
13
-
-
0000239121
-
-
Snyder, J. P., Ed.; Academic Press: New York
-
Dauben, H. J., Jr.; Wilson, J. D.; Laity, J. L. In Nonbenzenoid Aromatics; Snyder, J. P., Ed.; Academic Press: New York, 1971; Vol. II, pp 167-206.
-
(1971)
Nonbenzenoid Aromatics
, vol.2
, pp. 167-206
-
-
Dauben H.J., Jr.1
Wilson, J.D.2
Laity, J.L.3
-
15
-
-
0011190497
-
-
Schleyer, P. v. R.; Maerker, C.; Dransfeld, A.; Jiao, H.; Hommes, N. J. v. E. J. Am. Chem. Soc. 1996, 118, 6317-6318.
-
(1996)
J. Am. Chem. Soc.
, vol.118
, pp. 6317-6318
-
-
Schleyer, P.V.R.1
Maerker, C.2
Dransfeld, A.3
Jiao, H.4
Hommes, N.J.V.E.5
-
16
-
-
0037154717
-
-
Cyranski, M. K.; Krygowski, T. M.; Katritzky, A. R.; Schleyer, P. v. R. J. Org. Chem. 2002, 67, 1333-1338.
-
(2002)
J. Org. Chem.
, vol.67
, pp. 1333-1338
-
-
Cyranski, M.K.1
Krygowski, T.M.2
Katritzky, A.R.3
Schleyer, P.V.R.4
-
17
-
-
0000345199
-
-
Katritzky, A. R.; Karelson, M.; Sild, S.; Krygowski, T. M.; Jug, K. J. Org. Chem. 1998, 63, 5228-5231.
-
(1998)
J. Org. Chem.
, vol.63
, pp. 5228-5231
-
-
Katritzky, A.R.1
Karelson, M.2
Sild, S.3
Krygowski, T.M.4
Jug, K.5
-
18
-
-
0000140223
-
-
Malandra, J. L.; Mills, N. S.; Kadlecek, D. E.; Lowery, J. A. J. Am. Chem. Soc. 1994, 116, 11622-11624.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 11622-11624
-
-
Malandra, J.L.1
Mills, N.S.2
Kadlecek, D.E.3
Lowery, J.A.4
-
19
-
-
1542527737
-
-
Mills, N. S.; Malandra, J. L.; Burns, E. E.; Green, A.; Unruh, K. E.; Kadlecek, D. E.; Lowery, J. A. J. Org. Chem. 1997, 62, 9318-9322.
-
(1997)
J. Org. Chem.
, vol.62
, pp. 9318-9322
-
-
Mills, N.S.1
Malandra, J.L.2
Burns, E.E.3
Green, A.4
Unruh, K.E.5
Kadlecek, D.E.6
Lowery, J.A.7
-
20
-
-
0000830612
-
-
Mills, N. S.; Burns, E. B.; Hodges, J.; Gibbs, J.; Esparza, E.; Malandra, J. L.; Koch, J. J. Org. Chem. 1998, 63, 3017-3022.
-
(1998)
J. Org. Chem.
, vol.63
, pp. 3017-3022
-
-
Mills, N.S.1
Burns, E.B.2
Hodges, J.3
Gibbs, J.4
Esparza, E.5
Malandra, J.L.6
Koch, J.7
-
21
-
-
0033593385
-
-
Mills, N. S.; Malinky, T.; Malandra, J. L.; Burns, E. E.; Crossno, P. J. Org. Chem. 1999, 64, 511-517.
-
(1999)
J. Org. Chem.
, vol.64
, pp. 511-517
-
-
Mills, N.S.1
Malinky, T.2
Malandra, J.L.3
Burns, E.E.4
Crossno, P.5
-
23
-
-
0037023424
-
-
Mills, N. S.; Benish, M. M.; Ybarra, C. J. Org. Chem. 2002, 67, 2003-2012.
-
(2002)
J. Org. Chem.
, vol.67
, pp. 2003-2012
-
-
Mills, N.S.1
Benish, M.M.2
Ybarra, C.3
-
24
-
-
0001562025
-
-
Amyes, T. L.; Richard, J. P.; Novak, M. J. Am. Chem. Soc. 1992, 114, 8032-8041.
-
(1992)
J. Am. Chem. Soc.
, vol.114
, pp. 8032-8041
-
-
Amyes, T.L.1
Richard, J.P.2
Novak, M.3
-
25
-
-
1842333329
-
-
Jiao, H.; Schleyer, P. v. R.; Mo, Y.; McAllister, M. A.; Tidwell, T. T. J. Am. Chem. Soc, 1997, 119, 7075-7083.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 7075-7083
-
-
Jiao, H.1
Schleyer, P.V.R.2
Mo, Y.3
McAllister, M.A.4
Tidwell, T.T.5
-
28
-
-
0000446410
-
-
Fleischer, U.; Kutzelnigg, W.; Lazzeretti, P.; Mühlenkamp, V. J. J. Am. Chem. Soc. 1994, 116, 5298-5306.
-
(1994)
J. Am. Chem. Soc.
, vol.116
, pp. 5298-5306
-
-
Fleischer, U.1
Kutzelnigg, W.2
Lazzeretti, P.3
Mühlenkamp, V.J.4
-
29
-
-
0000662399
-
-
Schleyer, P. v. R.; Jiao, H.; van Eikema Hommes, N. J. R.; Malkin, V. G.; Malkina, O. L. J. Am. Chem. Soc. 1997, 119, 12669-12670.
-
(1997)
J. Am. Chem. Soc.
, vol.119
, pp. 12669-12670
-
-
Schleyer, P.V.R.1
Jiao, H.2
Van Eikema Hommes, N.J.R.3
Malkin, V.G.4
Malkina, O.L.5
-
30
-
-
0042888578
-
-
Schleyer, P. v. R.; Manoharan, M.; Wang, Z.-X.; Kiran, B.; Jiao, H.; Puchta, R.; Hommes, N. J. R. v. E. Org. Lett. 2001, 3, 2465-2468.
-
(2001)
Org. Lett.
, vol.3
, pp. 2465-2468
-
-
Schleyer, P.V.R.1
Manoharan, M.2
Wang, Z.-X.3
Kiran, B.4
Jiao, H.5
Puchta, R.6
Hommes, N.J.R.V.E.7
-
31
-
-
0004133516
-
-
Gaussian, Inc.; Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Scuseria, G. E.; Robb, M. A.; Cheeseman, J. R.; Zakrzewski, V. G.; Montgomery, J. A., Jr.; Stratmann, R. E.; Burant, J. C.; Dapprich, S.; Millam, J. M.; Daniels, A. D.; Kudin, K. N.; Strain, M. C.; Farkas, O.; Tomasi, J.; Barone, V.; Cossi, M.; Cammi, R.; Mennucci, B.; Pomelli, C.; Adamo, C.; Clifford, S.; Ochterski, J.; Petersson, G. A.; Ayala, P. Y.; Cui, Q.; Morokuma, K.; Malick, D. K.; Rabuck, A. D.; Raghavachari, K.; Foresman, J. B.; Cioslowski, J.; Ortiz, J. V.; Stefanov, B. B.; Liu, G.; Liashenko, A.; Piskorz, P.; Komaromi, I.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Keith, T.; Al-Laham, M. A.; Peng, C. Y.; Nanayakkara, A.; Gonzalez, C.; Challacombe, M.; Gill, P. M. W.; Johnson, B. G.; Chen, W.; Wong, M. W.; Andres, J. L.; Head-Gordon, M.; Replogle, E. S.; Pople, J. A. Gaussian 98, revision A.7; Gaussian, Inc.: Pittsburgh, PA, 1998.
-
(1998)
Gaussian 98, revision A.7
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Cheeseman, J.R.6
Zakrzewski, V.G.7
Montgomery J.A., Jr.8
Stratmann, R.E.9
Burant, J.C.10
Dapprich, S.11
Millam, J.M.12
Daniels, A.D.13
Kudin, K.N.14
Strain, M.C.15
Farkas, O.16
Tomasi, J.17
Barone, V.18
Cossi, M.19
Cammi, R.20
Mennucci, B.21
Pomelli, C.22
Adamo, C.23
Clifford, S.24
Ochterski, J.25
Petersson, G.A.26
Ayala, P.Y.27
Cui, Q.28
Morokuma, K.29
Malick, D.K.30
Rabuck, A.D.31
Raghavachari, K.32
Foresman, J.B.33
Cioslowski, J.34
Ortiz, J.V.35
Stefanov, B.B.36
Liu, G.37
Liashenko, A.38
Piskorz, P.39
Komaromi, I.40
Gomperts, R.41
Martin, R.L.42
Fox, D.J.43
Keith, T.44
Al-Laham, M.A.45
Peng, C.Y.46
Nanayakkara, A.47
Gonzalez, C.48
Challacombe, M.49
Gill, P.M.W.50
Johnson, B.G.51
Chen, W.52
Wong, M.W.53
Andres, J.L.54
Head-Gordon, M.55
Replogle, E.S.56
Pople, J.A.57
more..
-
32
-
-
0004133516
-
-
Gaussian, Inc.; Pittsburgh, PA
-
Frisch, M. J.; Trucks, G. W.; Schlegel, H. B.; Gill, P. M. W.; Johnson, B. G.; Robb, M. A.; Cheeseman, J. R.; Keith, T.; Petersson, G. A.; Montgomery, J. A.; Raghavachari, K.; Al-Laham, M. A.; Zakrzewski, V. G.; Ortiz, J. V.; Foresman, J. B.; Cioslowski, J.; Stefanov, B. B.; Nanayakkara, A.; Challacombe, M.; Peng, C. Y.; Ayala, P. Y.; Chen, W.; Wong, M. W.; Andres, J. L.; Replogle, E. S.; Gomperts, R.; Martin, R. L.; Fox, D. J.; Binkley, J. S.; Defrees, D. J.; Baker, J.; Stewart, J. P.; Head-Gordon, M.; Gonzalez, C.; Pople, J. A. Gaussian 94, revision E.2; Gaussian, Inc.: Pittsburgh, PA, 1995.
-
(1995)
Gaussian 94, revision E.2
-
-
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.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.P.32
Head-Gordon, M.33
Gonzalez, C.34
Pople, J.A.35
more..
-
33
-
-
0004165142
-
-
Springer-Verlag: Berlin, Germany
-
Kutzelnigg, W.; Schindler, M.; Fleischer, U. NMR, Basic Principles and Progress; Springer-Verlag: Berlin, Germany, 1990.
-
(1990)
NMR, Basic Principles and Progress
-
-
Kutzelnigg, W.1
Schindler, M.2
Fleischer, U.3
-
35
-
-
0034256638
-
-
Manoharan, M.; De Proft, F.; Geerlings, P. J. Chem. Soc., Perkin Trans. 2 2000, 8, 1767-1773.
-
(2000)
J. Chem. Soc., Perkin Trans. 2
, vol.8
, pp. 1767-1773
-
-
Manoharan, M.1
De Proft, F.2
Geerlings, P.3
-
36
-
-
0034703415
-
-
Manoharan, M.; De Proft, F.; Geerlings, P. J. Org. Chem. 2000, 65, 6132-6137.
-
(2000)
J. Org. Chem.
, vol.65
, pp. 6132-6137
-
-
Manoharan, M.1
De Proft, F.2
Geerlings, P.3
-
37
-
-
0034143285
-
-
Zhou, L.; Zhang, Y.; Wu, L.; Li, J. THEOCHEM 2000, 497, 137-144.
-
(2000)
THEOCHEM
, vol.497
, pp. 137-144
-
-
Zhou, L.1
Zhang, Y.2
Wu, L.3
Li, J.4
-
38
-
-
0030457576
-
-
Subramanian, G.; Schleyer, P. v. R.; Jiao, H. Angew. Chem., Int. Ed. Engl. 1996, 35, 2638-2640.
-
(1996)
Angew. Chem., Int. Ed. Engl.
, vol.35
, pp. 2638-2640
-
-
Subramanian, G.1
Schleyer, P.V.R.2
Jiao, H.3
-
41
-
-
0001407991
-
-
Lazzeretti, P.; Malagoli, M.; Zanasi, R. Chem. Phys. Lett. 1994, 220, 299-304.
-
(1994)
Chem. Phys. Lett.
, vol.220
, pp. 299-304
-
-
Lazzeretti, P.1
Malagoli, M.2
Zanasi, R.3
-
42
-
-
0000584523
-
-
Helgaker, T.; Jaszunski, M.; Ruud, K. Chem. Rev. 1999, 99, 293-352.
-
(1999)
Chem. Rev.
, vol.99
, pp. 293-352
-
-
Helgaker, T.1
Jaszunski, M.2
Ruud, K.3
-
44
-
-
0039005978
-
-
Vrcek, V.; Kronja, O.; Siehl, H.-U. J. Chem. Soc., Perkin Trans. 2 1999, 1317-1321.
-
(1999)
J. Chem. Soc., Perkin Trans. 2
, pp. 1317-1321
-
-
Vrcek, V.1
Kronja, O.2
Siehl, H.-U.3
-
45
-
-
0001741614
-
-
Rablen, P.; Pearlman, S. A.; Finkbiner, J. J. Phys. Chem. A 1999, 103, 7357-7363.
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 7357-7363
-
-
Rablen, P.1
Pearlman, S.A.2
Finkbiner, J.3
-
46
-
-
2142815216
-
-
note
-
A search of Chemical Abstracts reveals 459 references to calculations of magnetic properties by IGLO and only 46 references to CSGT calculations.
-
-
-
-
47
-
-
0001613883
-
-
Evdokimov, A. G.; Kalb, A. J.; Koetzle, T. F.; Klooster, W. T.; Martin, J. M. L. J. Phys. Chem. A 1999, 103, 744-753.
-
(1999)
J. Phys. Chem. A
, vol.103
, pp. 744-753
-
-
Evdokimov, A.G.1
Kalb, A.J.2
Koetzle, T.F.3
Klooster, W.T.4
Martin, J.M.L.5
-
48
-
-
0034670624
-
-
Rasul, G.; Prakash, G. K. S.; Olah, G. A. J. Org. Chem. 2000, 65, 8786-8789.
-
(2000)
J. Org. Chem.
, vol.65
, pp. 8786-8789
-
-
Rasul, G.1
Prakash, G.K.S.2
Olah, G.A.3
-
49
-
-
0000676487
-
-
Nendel, M.; Houk, K. N.; Tolbert, L. M.; Vogel, E.; Jiao, H.; Schleyer, P. v. R. J. Phys. Chem. A 1998, 102, 7191-7198.
-
(1998)
J. Phys. Chem. A
, vol.102
, pp. 7191-7198
-
-
Nendel, M.1
Houk, K.N.2
Tolbert, L.M.3
Vogel, E.4
Jiao, H.5
Schleyer, P.V.R.6
-
51
-
-
2142698076
-
-
note
-
The NICS values reported in this article are done with a basis set that is known to overestimate aromaticity, but the proton chemical shifts for anthracene, 7.98 and 7.44 ppm, certainly do not indicate antiaromaticity.
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