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1
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33846059169
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-
For reviews, see:
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-
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2
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33846040996
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Gleiter R., and Hopf H. (Eds), Wiley-VCH, Weinheim
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Tsuji T. In: Gleiter R., and Hopf H. (Eds). Modern Cyclophane Chemistry (2004), Wiley-VCH, Weinheim 8-104
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(2004)
Modern Cyclophane Chemistry
, pp. 8-104
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-
Tsuji, T.1
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12
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33846039620
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All spectroscopic data are also in accordance with those published in the literature:
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17
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0000533771
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For a review, see:
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For a review, see:. Hoffmann R.W. Acc. Chem. Res. 18 (1985) 248
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(1985)
Acc. Chem. Res.
, vol.18
, pp. 248
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-
Hoffmann, R.W.1
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18
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33846104727
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-
A silver(I) promoted opening of a highly strained three-membered ring has been reported:
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20
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33846102772
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note
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Please note that the numbering scheme applied for the X-ray structures of 10 and 11 differ from those according to the IUPAC nomenclature.
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21
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0034647909
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van Eis M.J., van der Linde B.S.E., de Kanter F.J.J., de Wolf W.H., and Bickelhaupt F. J. Org. Chem. 65 (2000) 4348
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(2000)
J. Org. Chem.
, vol.65
, pp. 4348
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-
van Eis, M.J.1
van der Linde, B.S.E.2
de Kanter, F.J.J.3
de Wolf, W.H.4
Bickelhaupt, F.5
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23
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0032786371
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Guillier F., Nivoliers F., Godard A., Marsais F., and Queguiner G. J. Heterocycl. Chem. 36 (1999) 1157
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(1999)
J. Heterocycl. Chem.
, vol.36
, pp. 1157
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-
Guillier, F.1
Nivoliers, F.2
Godard, A.3
Marsais, F.4
Queguiner, G.5
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24
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33846090909
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note
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The structures of 2b and 11 were optimized at the B3LYP/6-31G* level of theory without imposing geometric constraints.
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25
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33846078253
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note
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All calculations were performed with the program Spartan 04 suit of programs: SPARTAN'04, Wavefunction Inc., 18401 Von Karman Avenue, Suite 370, Irvine, CA 92612, www.wavefun.com.
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26
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0035936778
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cf.
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cf. Wijsman G.W., Iglesias G.A., Beekman M.C., de Wolf W.H., Bickelhaupt F., Kooijman H., and Spek A.L. J. Org. Chem. 66 (2001) 1216
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(2001)
J. Org. Chem.
, vol.66
, pp. 1216
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-
Wijsman, G.W.1
Iglesias, G.A.2
Beekman, M.C.3
de Wolf, W.H.4
Bickelhaupt, F.5
Kooijman, H.6
Spek, A.L.7
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27
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33846038477
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For references about the concept of olefinic strain (OS), see:
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30
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33846086266
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note
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According to a classification by Maier and Schleyer only those anti-Bredt compounds with an OS-value <17 kcal/mol are isolable at room temperature, see Ref. 17.
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32
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0003567345
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The DIRDIF Program System
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University of Nijmegen, Nijmegen, The Netherlands
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Beurskens P.T., Admiraal G., Beurskens G., Bosman W.P., Garcia-Granda S., Gould R.O., Smits J.M.M., and Smykalla C. The DIRDIF Program System. Technical Report of the Crystallographic Laboratory (1996), University of Nijmegen, Nijmegen, The Netherlands
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(1996)
Technical Report of the Crystallographic Laboratory
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-
Beurskens, P.T.1
Admiraal, G.2
Beurskens, G.3
Bosman, W.P.4
Garcia-Granda, S.5
Gould, R.O.6
Smits, J.M.M.7
Smykalla, C.8
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36
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33846080346
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The Monte Carlo method implemented in Spartan 04 suit of programs has been used. For the original Monte Carlo paper, see:
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37
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5744249209
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Metropolis N., Rosenbluth A.W., Rosenbluth M.N., Teller A.H., and Teller E. J. Chem. Phys. 21 (1953) 1087
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(1953)
J. Chem. Phys.
, vol.21
, pp. 1087
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-
Metropolis, N.1
Rosenbluth, A.W.2
Rosenbluth, M.N.3
Teller, A.H.4
Teller, E.5
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