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q. v. for other relevant references
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12
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8944241372
-
-
Wüstefeld, M., reported in ref 6, Tables 25, 37, 38, and 45
-
Wüstefeld, M., reported in ref 6, Tables 25, 37, 38, and 45.
-
-
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13
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84988087916
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Roth, W. R.; Staemmler, V.; Neumann, M.; Schmuck, C. Liebigs Ann. 1995, 1061-1118.
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Roth, W.R.1
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15
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0000201335
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(b) Doering, W. von E.; Birladeanu, L.; Cheng, X-h.; Kitagawa, T.; Sarma, K. J. Am. Chem. Soc. 1991, 113, 4558-4563.
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Doering, W.V.E.1
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Sarma, K.5
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17
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0001228895
-
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(d) Doering, W. von E.; Shi, Y.-q.; Zhao, D.-c. J. Am. Chem. Soc. 1992, 114, 10763-10766.
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Doering, W.V.E.1
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18
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4243973410
-
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and references cited therein
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McMurry, J. E. Chem. Rev. 1989, 89, 1513-1524, and references cited therein.
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McMurry, J.E.1
-
21
-
-
8944253368
-
-
note
-
This structure, determined by Mr. Mihai Azimioara, will be published elsewhere.
-
-
-
-
22
-
-
0039636621
-
-
(a) Traetteberg, M.; Bakken, P.; Almenningen, A.; Lüttke, W,; Janssen, J. J. Mol. Struct. 1982, 81, 87-103. Lütke, J. Mol. Struct. 1982, 81, 87-00.
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Traetteberg, M.1
Bakken, P.2
Almenningen, A.3
Lüttke, W.4
Janssen, J.5
-
23
-
-
0039636621
-
-
(a) Traetteberg, M.; Bakken, P.; Almenningen, A.; Lüttke, W,; Janssen, J. J. Mol. Struct. 1982, 81, 87-103. Lütke, J. Mol. Struct. 1982, 81, 87-00.
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-
-
Lütke1
-
24
-
-
8944252398
-
-
(b) Noltemeyer, M.; Janssen, J.; Lüttke, W. J. Mol. Struct. 1982, 81, 105-112. This structure has been redetermined by Professor Roland Boese, Institut für Anorganische Chemie, Universität Essen, and will be published elsewhere.
-
(1982)
J. Mol. Struct.
, vol.81
, pp. 105-112
-
-
Noltemeyer, M.1
Janssen, J.2
Lüttke, W.3
-
25
-
-
8944240444
-
-
note
-
7b (data on all previously studied trienes and pentaenes in the series of semirigid polyenes are collected in Table 4 of ref 7d) are essentially indistinguishable.
-
-
-
-
26
-
-
0001530915
-
-
See for example: Clark, K. B.; Wayner, D. D. M.; Demirdji, S. H.; Koch, T. H. J. Am. Chem. Soc. 1993, 115, 2447-2453.
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J. Am. Chem. Soc.
, vol.115
, pp. 2447-2453
-
-
Clark, K.B.1
Wayner, D.D.M.2
Demirdji, S.H.3
Koch, T.H.4
-
27
-
-
8944255224
-
-
note
-
o (favoring the anti isomer) varying narrowly between 0.3 and 1.0 kcal/mol was considered reassuring.
-
-
-
-
29
-
-
8944262272
-
-
note
-
As made available in the CSC Chem3D Plus program by Cambridge Scientific Computing, Inc.
-
-
-
-
30
-
-
0000617085
-
-
Roth, W. R.; Adamczak, O.; Breuckmann, R.; Lennartz, H.-W.; Boese, R. Chem. Ber. 1991, 124, 2499-2521.
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(1991)
Chem. Ber.
, vol.124
, pp. 2499-2521
-
-
Roth, W.R.1
Adamczak, O.2
Breuckmann, R.3
Lennartz, H.-W.4
Boese, R.5
-
31
-
-
8944262105
-
-
See ref 6 for references
-
See ref 6 for references.
-
-
-
-
32
-
-
8944255676
-
-
note
-
We are much indebted to Dr. Johannes Benkoff for these calculations.
-
-
-
-
33
-
-
84984336397
-
-
Doering, W. v. E.; Roth, W. R.; Bauer, F.; Breuckmann, R.; Ebbrecht, T.; Herbold, M.; Schmidt, R.; Lennartz, H.-W.; Lenoir, D.; Boese, R. Chem. Ber. 1989, 122, 1263-1275.
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(1989)
Chem. Ber.
, vol.122
, pp. 1263-1275
-
-
Doering, W.V.E.1
Roth, W.R.2
Bauer, F.3
Breuckmann, R.4
Ebbrecht, T.5
Herbold, M.6
Schmidt, R.7
Lennartz, H.-W.8
Lenoir, D.9
Boese, R.10
-
34
-
-
8944231215
-
-
[(65.9) - (40.1 + 7.0) + (2 × 3.75)]/2 = 13.2 kcal/mol
-
[(65.9) - (40.1 + 7.0) + (2 × 3.75)]/2 = 13.2 kcal/mol.
-
-
-
-
35
-
-
84941781164
-
-
Doering, W. v. E.; Roth, W. R.; Bauer, F.; Boenke, M.; Breuckmann, R.; Ruhkamp, J.; Wortmann. O. Chem. Ber. 1991, 124, 1461-1470.
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(1991)
Chem. Ber.
, vol.124
, pp. 1461-1470
-
-
Doering, W.V.E.1
Roth, W.R.2
Bauer, F.3
Boenke, M.4
Breuckmann, R.5
Ruhkamp, J.6
Wortmann, O.7
-
36
-
-
8944261433
-
-
note
-
We express many thanks to Professor Wolfgang R. Roth, Ruhr Universität, Bochum, for suggesting and making these calculations.
-
-
-
-
37
-
-
8944250739
-
-
[(65.9) - (36.8 + 4.2) + (4 × 3.75)]/2 = 20.0 kcal/mol
-
[(65.9) - (36.8 + 4.2) + (4 × 3.75)]/2 = 20.0 kcal/mol.
-
-
-
-
38
-
-
8944248873
-
-
note
-
Because the derivation includes correction for steric factors by the MMEVBH program, the resulting value for the enthalpy of stabilization can be applied to other systems for the purpose of predicting enthalpies of activation involving the cyclohexadienyl radical only if this same program is used to estimate any steric corrections.
-
-
-
-
40
-
-
8944240442
-
-
note
-
7c Beyond this theoretical indication, there is no experimental evidence bearing on the question.
-
-
-
-
41
-
-
8944250738
-
-
note
-
28 hexa-1,5-diene, (Z)-hexene-3, n-hexane; (v) 2,3-dimethylbutadiene, 2,3-dimethylbutene-1,2,3-dimethylbutane.
-
-
-
-
43
-
-
0001087097
-
-
(b) Turner, R. B.; Mallon, B. J.; Tichy, M.; Doering, W. v. E.; Roth, W. R.; Schröder, G. J. Am. Chem. Soc. 1973, 95, 8605-8610.
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(1973)
J. Am. Chem. Soc.
, vol.95
, pp. 8605-8610
-
-
Turner, R.B.1
Mallon, B.J.2
Tichy, M.3
Doering, W.V.E.4
Roth, W.R.5
Schröder, G.6
-
44
-
-
0000387599
-
-
Turner, R. B.; Meador, W. R.; Doering, W. v. E.; Knox, L. H.; Mayer, J. R.; Wiley, D. W. J. Am. Chem. Soc. 1957, 79, 4127-4133.
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, vol.79
, pp. 4127-4133
-
-
Turner, R.B.1
Meador, W.R.2
Doering, W.V.E.3
Knox, L.H.4
Mayer, J.R.5
Wiley, D.W.6
-
48
-
-
8944251200
-
-
note
-
We are grateful to Professor D. W. Rogers, Long Island University, for the communication of this preliminary result.
-
-
-
-
49
-
-
8944256927
-
-
note
-
31
-
-
-
-
50
-
-
8944226182
-
-
See Scheme 6, page 1075 of ref 6
-
See Scheme 6, page 1075 of ref 6.
-
-
-
-
51
-
-
0000492148
-
-
Doering, W. von E.; Belfield, K. D.; He, J.-n. J. Am. Chem. Soc. 1993, 115, 5414-5421.
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Doering, W.V.E.1
Belfield, K.D.2
He, J.-N.3
-
52
-
-
8944262271
-
-
note
-
37
-
-
-
-
53
-
-
0000904052
-
-
Zimmermann, H. E.; Hackett, P.; Juers, D. F.; McCall, J. M.; Schröder, B. J. Am. Chem. Soc. 1971, 93, 3653-3662; Zimmermann, H. E.; Juers, D. F.; McCall, J. M.; Schröder, B. J. Am. Chem. Soc. 1971, 93, 3662-3674.
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Zimmermann, H.E.1
Hackett, P.2
Juers, D.F.3
McCall, J.M.4
Schröder, B.5
-
54
-
-
8944262106
-
-
Zimmermann, H. E.; Hackett, P.; Juers, D. F.; McCall, J. M.; Schröder, B. J. Am. Chem. Soc. 1971, 93, 3653-3662; Zimmermann, H. E.; Juers, D. F.; McCall, J. M.; Schröder, B. J. Am. Chem. Soc. 1971, 93, 3662-3674.
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-
-
Zimmermann, H.E.1
Juers, D.F.2
McCall, J.M.3
Schröder, B.4
-
55
-
-
8944240443
-
-
Ph.D. Dissertation, Harvard University, Cambridge, MA
-
Ekmanis, J. L., Ph.D. Dissertation, Harvard University, Cambridge, MA, 1976. Diss. Abstr. Int. B 1976, 37, 224B (Order No. 76-14,401).
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(1976)
-
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Ekmanis, J.L.1
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56
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8944259001
-
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Order No. 76-14,401
-
Ekmanis, J. L., Ph.D. Dissertation, Harvard University, Cambridge, MA, 1976. Diss. Abstr. Int. B 1976, 37, 224B (Order No. 76-14,401).
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(1976)
Diss. Abstr. Int. B
, vol.37
-
-
-
57
-
-
8944239468
-
-
note
-
30b to methylenecyclohexadiene (p-isotoluene); determination of heats of hydrogenation of further model compounds such as the mono- and di-olefins related to 3-methylene-6,6-dimethylcyclohexa-1,4-diene; establishment of the temperature dependence of the equilibrium constants among the several isomers of a triene such as 4,4-dimethylcyclohexa-1,4-dienylidene-4′,4′-dimethylcyclohexane.
-
-
-
-
59
-
-
84973886111
-
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Naya, K.1
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Fujiwara, M.3
Nakata, M.4
Ohtsuka, T.5
Kurio, S.6
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0346419334
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(b) Alunni, S.; Minuti, L.; Taticchi, A. J. Org. Chem. 1991, 56, 5353-5356.
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Alunni, S.1
Minuti, L.2
Taticchi, A.3
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