SCOPUS 정보 검색 플랫폼

International Journal of Quantum Chemistry

Volumn 65, Issue 5, 1997, Pages 767-785

A molecular orbital study of the dimerization process of vinyl monomers

(1) Mora, M A a

a UNIVERSIDAD AUTÓNOMA METROPOLITANA (Mexico)

Author keywords

[No Author keywords available]

Indexed keywords

EID: 0001299946 PISSN: 00207608 EISSN: None Source Type: Journal
DOI: 10.1002/(SICI)1097-461X(1997)65:5<767::AID-QUA43>3.0.CO;2-V Document Type: Article

Times cited : (5)

References (29)

1
- 0003451462
- Wiley, New York
- J. L. Koening, Chemical Microstructure of Polymer Chains (Wiley, New York, 1980).
- (1980) Chemical Microstructure of Polymer Chains
- Koening, J.L.¹

2
- 0347974222
- H. L. Frish, G. L. Mallows, F. Hestley, and F. A. Bovey, Macromolecules 1, 553 (1968).
- (1968) Macromolecules , vol.1 , pp. 553
- Frish, H.L.¹ Mallows, G.L.² Hestley, F.³ Bovey, F.A.⁴

3
- 0042306020
- C. H. Pichot, M. Llauro, and Q. Pham, J. Polym. Sci., Polym. Chem. Ed. 19, 2619 (1981).
- (1981) J. Polym. Sci., Polym. Chem. Ed. , vol.19 , pp. 2619
- Pichot, C.H.¹ Llauro, M.² Pham, Q.³

4
- 0010922186
- 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. Keith, G. A. Petersson, J. A. Montgomery, K. Raghavachari, M. A. AlLaham, V. G. Zakrzewski, J. V. Ortiz, J. B. Foresman, J. Cioslowski, B. B. Stefenov, A. Nanayakkara, M. Challacombe, C. Y. Peng, P. Y. Ayala, W. Chen, M. W. Wang, J. L. Andres, E. S. Replogle, R. Gomperts, R. L. Martin, D. J. Fox, J. S. Binkley, D. J. Defrees, J. Baker, J. P. Stewart, M. Head-Gordon, C. Gonzalez, and J. A. Pople, Gaussian 94, Revision D.4 (Gaussian, Inc., Pittsburgh, PA, 1995).
- (1995) Gaussian 94, Revision D.4
- 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 Allaham, M.A.¹² Zakrzewski, V.G.¹³ Ortiz, J.V.¹⁴ Foresman, J.B.¹⁵ Cioslowski, J.¹⁶ Stefenov, B.B.¹⁷ Nanayakkara, A.¹⁸ Challacombe, M.¹⁹ Peng, C.Y.²⁰ more..

5
- 0000210773
- M. J. S. Dewar, E. G. Zoeblisch, E. F. Ealy, and J. J. P. Stewart, J. Am. Chem. Soc. 107, 3902 (1965).
- (1965) J. Am. Chem. Soc. , vol.107 , pp. 3902
- Dewar, M.J.S.¹ Zoeblisch, E.G.² Ealy, E.F.³ Stewart, J.J.P.⁴

6
- 3342906428
- J. A. Pople and R. K. Nesbet, J. Chem. Phys. 22, 571 (1959).
- (1959) J. Chem. Phys. , vol.22 , pp. 571
- Pople, J.A.¹ Nesbet, R.K.²

7
- 2442617487
- J. S. Binkley, J. A. Pople, and W. J. Here, J. Am. Chem. Soc. 102, 939 (1980); M. S. Gordon, J. S. Binkley, J. A. Pople, W. J. Pietro, and W. J. Here, J. Am. Chem. Soc 104, 2797 (1982). W. J. Pietro, M. M. Frand, W. J. Here, D. J. Defrees, J. A. Pople, and J. S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982); K. D. Dobbs and W. J. Here, J. Comp. Chem. 7, 369 (1986); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 861 (1987); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 880 (1987).
- (1980) J. Am. Chem. Soc. , vol.102 , pp. 939
- Binkley, J.S.¹ Pople, J.A.² Here, W.J.³

8
- 33845555195
- J. S. Binkley, J. A. Pople, and W. J. Here, J. Am. Chem. Soc. 102, 939 (1980); M. S. Gordon, J. S. Binkley, J. A. Pople, W. J. Pietro, and W. J. Here, J. Am. Chem. Soc 104, 2797 (1982). W. J. Pietro, M. M. Frand, W. J. Here, D. J. Defrees, J. A. Pople, and J. S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982); K. D. Dobbs and W. J. Here, J. Comp. Chem. 7, 369 (1986); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 861 (1987); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 880 (1987).
- (1982) J. Am. Chem. Soc , vol.104 , pp. 2797
- Gordon, M.S.¹ Binkley, J.S.² Pople, J.A.³ Pietro, W.J.⁴ Here, W.J.⁵

9
- 0011965942
- J. S. Binkley, J. A. Pople, and W. J. Here, J. Am. Chem. Soc. 102, 939 (1980); M. S. Gordon, J. S. Binkley, J. A. Pople, W. J. Pietro, and W. J. Here, J. Am. Chem. Soc 104, 2797 (1982). W. J. Pietro, M. M. Frand, W. J. Here, D. J. Defrees, J. A. Pople, and J. S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982); K. D. Dobbs and W. J. Here, J. Comp. Chem. 7, 369 (1986); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 861 (1987); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 880 (1987).
- (1982) J. Am. Chem. Soc. , vol.104 , pp. 5039
- Pietro, W.J.¹ Frand, M.M.² Here, W.J.³ Defrees, D.J.⁴ Pople, J.A.⁵ Binkley, J.S.⁶

10
- 2442617487
- J. S. Binkley, J. A. Pople, and W. J. Here, J. Am. Chem. Soc. 102, 939 (1980); M. S. Gordon, J. S. Binkley, J. A. Pople, W. J. Pietro, and W. J. Here, J. Am. Chem. Soc 104, 2797 (1982). W. J. Pietro, M. M. Frand, W. J. Here, D. J. Defrees, J. A. Pople, and J. S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982); K. D. Dobbs and W. J. Here, J. Comp. Chem. 7, 369 (1986); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 861 (1987); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 880 (1987).
- (1986) J. Comp. Chem. , vol.7 , pp. 369
- Dobbs, K.D.¹ Here, W.J.²

11
- 84988112847
- J. S. Binkley, J. A. Pople, and W. J. Here, J. Am. Chem. Soc. 102, 939 (1980); M. S. Gordon, J. S. Binkley, J. A. Pople, W. J. Pietro, and W. J. Here, J. Am. Chem. Soc 104, 2797 (1982). W. J. Pietro, M. M. Frand, W. J. Here, D. J. Defrees, J. A. Pople, and J. S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982); K. D. Dobbs and W. J. Here, J. Comp. Chem. 7, 369 (1986); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 861 (1987); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 880 (1987).
- (1987) J. Comp. Chem. , vol.8 , pp. 861
- Dobbs, K.D.¹ Here, W.J.²

12
- 84871585496
- J. S. Binkley, J. A. Pople, and W. J. Here, J. Am. Chem. Soc. 102, 939 (1980); M. S. Gordon, J. S. Binkley, J. A. Pople, W. J. Pietro, and W. J. Here, J. Am. Chem. Soc 104, 2797 (1982). W. J. Pietro, M. M. Frand, W. J. Here, D. J. Defrees, J. A. Pople, and J. S. Binkley, J. Am. Chem. Soc. 104, 5039 (1982); K. D. Dobbs and W. J. Here, J. Comp. Chem. 7, 369 (1986); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 861 (1987); K. D. Dobbs and W. J. Here, J. Comp. Chem. 8, 880 (1987).
- (1987) J. Comp. Chem. , vol.8 , pp. 880
- Dobbs, K.D.¹ Here, W.J.²

13
- 36849115659
- R. Ditchfield, W. J. Hehre, and J. A. Pople, J. Chem. Phys. 54 724 (1971); W. J. Hehre, R. Ditchfield, and A. Pople, J. Chem. Phys. 56, 2257 (1972); P. C. Hariharan and J. A. Pople, Mol. Phys. 27, 209 (1974); M. S. Gordan, Chem. Phys. Lett. 76, 163 (1906); P. C. Hariharan and J. A. Pople, Theor. Chim. Acta 28, 213 (1973).
- (1971) J. Chem. Phys. , vol.54 , pp. 724
- Ditchfield, R.¹ Hehre, W.J.² Pople, J.A.³

14
- 0347170005
- R. Ditchfield, W. J. Hehre, and J. A. Pople, J. Chem. Phys. 54 724 (1971); W. J. Hehre, R. Ditchfield, and A. Pople, J. Chem. Phys. 56, 2257 (1972); P. C. Hariharan and J. A. Pople, Mol. Phys. 27, 209 (1974); M. S. Gordan, Chem. Phys. Lett. 76, 163 (1906); P. C. Hariharan and J. A. Pople, Theor. Chim. Acta 28, 213 (1973).
- (1972) J. Chem. Phys. , vol.56 , pp. 2257
- Hehre, W.J.¹ Ditchfield, R.² Pople, A.³

15
- 0000812163
- R. Ditchfield, W. J. Hehre, and J. A. Pople, J. Chem. Phys. 54 724 (1971); W. J. Hehre, R. Ditchfield, and A. Pople, J. Chem. Phys. 56, 2257 (1972); P. C. Hariharan and J. A. Pople, Mol. Phys. 27, 209 (1974); M. S. Gordan, Chem. Phys. Lett. 76, 163 (1906); P. C. Hariharan and J. A. Pople, Theor. Chim. Acta 28, 213 (1973).
- (1974) Mol. Phys. , vol.27 , pp. 209
- Hariharan, P.C.¹ Pople, J.A.²

16
- 0000513049
- R. Ditchfield, W. J. Hehre, and J. A. Pople, J. Chem. Phys. 54 724 (1971); W. J. Hehre, R. Ditchfield, and A. Pople, J. Chem. Phys. 56, 2257 (1972); P. C. Hariharan and J. A. Pople, Mol. Phys. 27, 209 (1974); M. S. Gordan, Chem. Phys. Lett. 76, 163 (1906); P. C. Hariharan and J. A. Pople, Theor. Chim. Acta 28, 213 (1973).
- (1906) Chem. Phys. Lett. , vol.76 , pp. 163
- Gordan, M.S.¹

17
- 33748545144
- R. Ditchfield, W. J. Hehre, and J. A. Pople, J. Chem. Phys. 54 724 (1971); W. J. Hehre, R. Ditchfield, and A. Pople, J. Chem. Phys. 56, 2257 (1972); P. C. Hariharan and J. A. Pople, Mol. Phys. 27, 209 (1974); M. S. Gordan, Chem. Phys. Lett. 76, 163 (1906); P. C. Hariharan and J. A. Pople, Theor. Chim. Acta 28, 213 (1973).
- (1973) Theor. Chim. Acta , vol.28 , pp. 213
- Hariharan, P.C.¹ Pople, J.A.²

18
- 0003456926
- McGraw-Hill, New York
- M. J. S. Dewar, The Molecular Orbital Theory of Organic Chemistry (McGraw-Hill, New York, 1969).
- (1969) The Molecular Orbital Theory of Organic Chemistry
- Dewar, M.J.S.¹

19
- 24444468650
- M. J. S. Dewar and W. Thiel, J. Am. Chem. Soc. 99, 4899 (1977); Ibid. 99, 4907 (1977); J. J. P. Stewart and M. J. S. Dewar, MOPAC 4.0, QCPE #455 (Bloomington, IN, 1987).
- (1977) J. Am. Chem. Soc. , vol.99 , pp. 4899
- Dewar, M.J.S.¹ Thiel, W.²

20
- 33847087937
- M. J. S. Dewar and W. Thiel, J. Am. Chem. Soc. 99, 4899 (1977); Ibid. 99, 4907 (1977); J. J. P. Stewart and M. J. S. Dewar, MOPAC 4.0, QCPE #455 (Bloomington, IN, 1987).
- (1977) J. Am. Chem. Soc. , vol.99 , pp. 4907

21
- 33847087937
- QCPE #455 Bloomington, IN
- M. J. S. Dewar and W. Thiel, J. Am. Chem. Soc. 99, 4899 (1977); Ibid. 99, 4907 (1977); J. J. P. Stewart and M. J. S. Dewar, MOPAC 4.0, QCPE #455 (Bloomington, IN, 1987).
- (1987) MOPAC 4.0
- Stewart, J.J.P.¹ Dewar, M.J.S.²

22
- 0022076689
- M. J. S. Dewar and D. M. Storch, J. Am. Chem. Soc 107, 3898 (1983).
- (1983) J. Am. Chem. Soc , vol.107 , pp. 3898
- Dewar, M.J.S.¹ Storch, D.M.²

23
- 0027814696
- M. A. Mora, M. Rubio, and R. Salcedo, Polymer 34, 5143 (1993).
- (1993) Polymer , vol.34 , pp. 5143
- Mora, M.A.¹ Rubio, M.² Salcedo, R.³

24
- 0001464677
- P. J. Flory, P. R. Sundararajan, and L. C. DeBolt, J. Am. Chem. Soc. 96, 5015 (1974).
- (1974) J. Am. Chem. Soc. , vol.96 , pp. 5015
- Flory, P.J.¹ Sundararajan, P.R.² DeBolt, L.C.³

25
- 0003961210
- McGraw-Hill, New York
- F. Rodriguez, Principles of Polymer Systems (McGraw-Hill, New York, 1982); P. J. Flory, Principles of Polymer Chemistry (Cornell University Press, Ithaca, NY, London, 1978).
- (1982) Principles of Polymer Systems
- Rodriguez, F.¹

26
- 0003411482
- Cornell University Press, Ithaca, NY, London
- F. Rodriguez, Principles of Polymer Systems (McGraw-Hill, New York, 1982); P. J. Flory, Principles of Polymer Chemistry (Cornell University Press, Ithaca, NY, London, 1978).
- (1978) Principles of Polymer Chemistry
- Flory, P.J.¹

27
- 5644260918
- George E. Ham, Ed. Marcel Dekker, New York, Chap. 8
- R. M. Joshy, B. J. Zwolinksi, in Vinyl Polymerizations, George E. Ham, Ed. (Marcel Dekker, New York, 1967), Vol. 1, Chap. 8.
- (1967) Vinyl Polymerizations , vol.1
- Joshy, R.M.¹ Zwolinksi, B.J.²

28
- 0003411482
- Cornell University Press, Ithaca, NY
- P. J. Flory, Principles of Polymer Chemistry (Cornell University Press, Ithaca, NY, 1953), p. 254.
- (1953) Principles of Polymer Chemistry , pp. 254
- Flory, P.J.¹

29
- 5644231689
- C. E. Schildknecht, S. T. Cross, H. R. Davison, J. M. Lambert, and A. O. Zoss, Ind. Eng. Chem. 40, 2014 (1948).
- (1948) Ind. Eng. Chem. , vol.40 , pp. 2014
- Schildknecht, C.E.¹ Cross, S.T.² Davison, H.R.³ Lambert, J.M.⁴ Zoss, A.O.⁵

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.