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0035353485
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SLAYDEN, S. W., and LIEBMAN, J. F., 2001, Chem. Rev., 101, 1541.
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(a) CHICKOS, J. S., HILLESHEIM, D. M., VEREVKIN, S. P., ROUX, M. V., TEMPRADO, M., SEGURA, M., NOTARIO, R., DEMASTERS, D. E., and LIEBMAN, J. F., 2003, Molec. Phys., 101, 1311
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Temprado, M.5
Segura, M.6
Notario, R.7
Demasters, D.E.8
Liebman, J.F.9
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0347131170
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Notario, R.3
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84873055189
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HEHRE, W. J., RADOM, L., SCHLEYER, P. V. R., and POPLE, J. A., 1986, Ab Initio Molecular Orbital Theory (New York: Wiley).
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Ab Initio Molecular Orbital Theory
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Hehre, W.J.1
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FRISCH, M. J., TRUCKS, G. W., SCHLEGEL, H. B., SCUSERIA, G. E., ROBB, M. A., CHEESEMAN, J. R., ZAKRZEWSKI, V. G., MONTGOMERY, JR., J. A., 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., REGA, N., SALVADOR, P., DANNENBERG, J. J., MALICK, D. K., RABUCK, A. D., RAGHAVACHARI, K., FORESMAN, J., B., CIOSLOWSKI, J., ORTIZ, J. V., BABOUL, A. G., STEFANOV, B. B., LIU, G., LIASHENKO, A., PISKORZ, P., KOMAROMI, I., GOMPERTS, R., MARTIN, J. L., FOX, D. J., KEITH, T., ALLAHAM, M. A., PENG, C. Y., NANAYAKKARA, A., CHALLACOMBE, M., GILL, P. M. W., JOHNSON, B., CHEN, W., WONG, M. W., ANDRES, J. L., GONZALEZ, C., HEAD-GORDON, M., REPLOGLE, E. S., and POPLE, J. A., 2002, Gaussian 98, revision A.11.3 (Pittsburg, PA: Gaussian, Inc.).
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Gaussian 98, Revision A.11.3
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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 Jr., J.A.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
Rega, N.30
Salvador, P.31
Dannenberg, J.J.32
Malick, D.K.33
Rabuck, A.D.34
Raghavachari, K.35
Foresman, J.B.36
Cioslowski, J.37
Ortiz, J.V.38
Baboul, A.G.39
Stefanov, B.B.40
Liu, G.41
Liashenko, A.42
Piskorz, P.43
Komaromi, I.44
Gomperts, R.45
Martin, J.L.46
Fox, D.J.47
Keith, T.48
Allaham, M.A.49
Peng, C.Y.50
Nanayakkara, A.51
Challacombe, M.52
Gill, P.M.W.53
Johnson, B.54
Chen, W.55
Wong, M.W.56
Andres, J.L.57
Gonzalez, C.58
Head-Gordon, M.59
Replogle, E.S.60
Pople, J.A.61
more..
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8
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0011083273
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SCOTT, A. P., and RADOM, L., 1996, J. phys. Chem., 100, 16 502.
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J. Phys. Chem.
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Scott, A.P.1
Radom, L.2
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9
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3042831032
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ROUX, M. V., and CHICKOS, J. S., 2002, unpublished analysis
-
ROUX, M. V., and CHICKOS, J. S., 2002, unpublished analysis.
-
-
-
-
10
-
-
0000357667
-
-
Mean value from (a) COX, J. D., 1961, Pure appl. Chem., 2, 125 and (b) ANDON, R. J. L., BIDDISCOMBE, D. P., COX, J. D., HANDLEY, R., HARROP, D., HERINGTON, E. F. G., and MARTIN, J. F., 1960, J. chem. Soc., 5246.
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(1961)
Pure Appl. Chem.
, vol.2
, pp. 125
-
-
Cox, J.D.1
-
11
-
-
37049064200
-
-
Mean value from (a) COX, J. D., 1961, Pure appl. Chem., 2, 125 and (b) ANDON, R. J. L., BIDDISCOMBE, D. P., COX, J. D., HANDLEY, R., HARROP, D., HERINGTON, E. F. G., and MARTIN, J. F., 1960, J. chem. Soc., 5246.
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J. Chem. Soc.
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Andon, R.J.L.1
Biddiscombe, D.P.2
Cox, J.D.3
Handley, R.4
Harrop, D.5
Herington, E.F.G.6
Martin, J.F.7
-
12
-
-
45449125638
-
-
Mean value from (a) RIBEIRO DA SILVA, M. A. V., RIBEIRO DA SILVA, M. D. M. C., and PILCHER, G., 1988, J. chem. Thermodyn., 20, 969 and (b) COLOMINA, M., ROUX, M. V., and TURRIÓN, C., 1974, J. chem. Thermodyn., 6, 571.
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(1988)
J. Chem. Thermodyn.
, vol.20
, pp. 969
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-
Ribeiro da Silva, M.A.V.1
Ribeiro da Silva, M.D.M.C.2
Pilcher, G.3
-
13
-
-
0001259176
-
-
Mean value from (a) RIBEIRO DA SILVA, M. A. V., RIBEIRO DA SILVA, M. D. M. C., and PILCHER, G., 1988, J. chem. Thermodyn., 20, 969 and (b) COLOMINA, M., ROUX, M. V., and TURRIÓN, C., 1974, J. chem. Thermodyn., 6, 571.
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(1974)
J. Chem. Thermodyn.
, vol.6
, pp. 571
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Colomina, M.1
Roux, M.V.2
Turrión, C.3
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15
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-
0000905010
-
-
STEELE, W. V., CHIRICO, R. D., and SMITH, N. K., 1995, J. chem. Thermodyn., 27, 671.
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(1995)
J. Chem. Thermodyn.
, vol.27
, pp. 671
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Steele, W.V.1
Chirico, R.D.2
Smith, N.K.3
-
16
-
-
0000254301
-
-
SABBAH, R., and LAFFITTE, M., 1978, Thermochim. Acta, 23, 196.
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(1978)
Thermochim. Acta
, vol.23
, pp. 196
-
-
Sabbah, R.1
Laffitte, M.2
-
17
-
-
0345980522
-
-
Mean value from (a) WATIK, L. E., and SABBAH, R., 1991, Bull. Soc. Chim. Fr., 128, 344 and (b) VEREVKIN, S. P., 1998, Thermochim. Acta, 310, 229.
-
(1991)
Bull. Soc. Chim. Fr.
, vol.128
, pp. 344
-
-
Watik, L.E.1
Sabbah, R.2
-
18
-
-
0001580927
-
-
Mean value from (a) WATIK, L. E., and SABBAH, R., 1991, Bull. Soc. Chim. Fr., 128, 344 and (b) VEREVKIN, S. P., 1998, Thermochim. Acta, 310, 229.
-
(1998)
Thermochim. Acta
, vol.310
, pp. 229
-
-
Verevkin, S.P.1
-
19
-
-
0344938974
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PARKS, G. S., and MOSLEY, J. R., 1950, J. Am. chem. Soc., 72, 1850.
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(1950)
J. Am. Chem. Soc.
, vol.72
, pp. 1850
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-
Parks, G.S.1
Mosley, J.R.2
-
20
-
-
0035697076
-
-
FREIERMUTH, B., HELLRUNG, B., PETERLI, S., SCHULTZ, M. F., WINTGENS, D., and WIRZ, J., 2001, Helv. Chim. Acta, 84, 3796; WIRZ, J., 2001, personal communication.
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(2001)
Helv. Chim. Acta
, vol.84
, pp. 3796
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-
Freiermuth, B.1
Hellrung, B.2
Peterli, S.3
Schultz, M.F.4
Wintgens, D.5
Wirz, J.6
-
21
-
-
0035697076
-
-
personal communication
-
FREIERMUTH, B., HELLRUNG, B., PETERLI, S., SCHULTZ, M. F., WINTGENS, D., and WIRZ, J., 2001, Helv. Chim. Acta, 84, 3796; WIRZ, J., 2001, personal communication.
-
(2001)
-
-
Wirz, J.1
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