X-ray crystal structure analysis and atomic charges of color former and developer 3. Color formers

Journal of Molecular Structure

Volumn 406, Issue 1-2, 1997, Pages 29-43

  Okada, Kenji ^a   Okada, Sachiko ^b  

^a RICOH COMPANY LTD   (Japan)

^b TOKYO UNIVERSITY OF SCIENCE   (Japan)

Author keywords

Color former; Stereochemistry; X ray crystallography

Indexed keywords

EID: 0030916217     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/S0022-2860(96)09441-0     Document Type: Article

References (41)

1. O.N. Witt, Ber. Dtsch. Chem. Ges., 9 (1876) 522.
2. R.S. Osborn and D. Rogers, Acta Cryst. B, 31 (1975) 359.
3. H. Kubata, H. Yoshioka, K. Nakatsu, M. Matsumoto and Y. Sato, J. Soc. Photograph. Sci. Tech. Jpn. (1989) 1AP-10; H. Kubata, H. Yoshioka, K. Nakatsu, M. Matsumoto and Y. Sato, Int. Symp. on Chemistry of Functional Dyes (1989) p. 223; J. Soc. Photograph. Sci. Tech. Jpn. (1990) 2A-5; 2B-20.
4. H. Kubata, H. Yoshioka, K. Nakatsu, M. Matsumoto and Y. Sato, J. Soc. Photograph. Sci. Tech. Jpn. (1989) 1AP-10; H. Kubata, H. Yoshioka, K. Nakatsu, M. Matsumoto and Y. Sato, Int. Symp. on Chemistry of Functional Dyes (1989) p. 223; J. Soc. Photograph. Sci. Tech. Jpn. (1990) 2A-5; 2B-20.
5. H. Kubata, H. Yoshioka, K. Nakatsu, M. Matsumoto and Y. Sato, J. Soc. Photograph. Sci. Tech. Jpn. (1989) 1AP-10; H. Kubata, H. Yoshioka, K. Nakatsu, M. Matsumoto and Y. Sato, Int. Symp. on Chemistry of Functional Dyes (1989) p. 223; J. Soc. Photograph. Sci. Tech. Jpn. (1990) 2A-5; 2B-20.
6. K. Orfishi, T. Ootsuka, S. Saito and K. Ibata, J. Soc. Photograph. Sci. Tech. Jpn. (1992) 2C6-09.
7. X.-L. Liu, J.-L. Wang, J.-W. Liu and F.-M. Miao, Acta Cryst. C, 51 (1995) 324.
8. G. Rihs and C.D. Weis, Dyes Pigments, 15 (1991) 165.
9. K. Okada, J. Mol. Struct., 380 (1996) 223.
10. K. Okada, J. Mol. Struct., 380 (1996) 235.
11. K. Okada and S. Okada, IUCr96, CGAIN Abstracts (1996), PS03.02.10, C-80.
12. S. Okada and K. Okada, Comput. Chem., 20 (1996) 267.
13. S. Okada and K. Okada, J. Chem. Inf. Comput. Sci., 34 (1994) 972.
14. K. Okada, J. Chem. Inf. Comput. Sci., 34 (1994) 594.
15. K. Okada, J. Chem. Inf. Comput. Sci., 33 (1993) 871.
16. D.W.J. Cruickshank, in J.S. Rollett (Ed.) Computing Methods in Crystallography, Pergamon, Oxford, 1965, pp. 112-116.
17. International Tables for X-ray Crystallography, Vol. IV, Kynoch, Birmingham, UK, 1974, pp. 99-102; p. 149.
18. International Tables for X-ray Crystallography, Vol. IV, Kynoch, Birmingham, UK, 1974, pp. 99-102; p. 149.
19. K. Okada and H. Koyama, J. Appl. Cryst., 24 (1991) 1067.
20. V. Schomaker and K.N. Trueblood, Acta Cryst. B, 24 (1968) 63.
21. K.N. Trueblood, Acta Cryst. A, 34 (1978) 950.
22. J.D. Dunitz and D.N.J. White, Acta Cryst. A, 29 (1973) 93.
23. K.N. Trueblood, THMA14, The computer program for thermal motion analysis including internal torsion, Univ. of California, Los Angeles, CA, 1992.
24. M. Nardelli, ROTENER, A Fortran Routine for Calculating Non-bonded Potential Energy, Univ. of Parma, Italy, 1992.
25. J. Gasteiger and M. Marsili, Tetrahedron, 36 (1980) 3219.
26. J.J.P. Stewart, J. Comput. Chem., 10 (1989) 209; 221.
27. J.J.P. Stewart, J. Comput. Chem., 10 (1989) 209; 221.
28. J.J.P. Stewart and F.J. Seiler, QCPE Bull., 10 (1990) 86.
29. D. Cremer and J.A. Pople, J. Am. Chem. Soc., 97 (1975) 1354.
30. M. Nardelli, Acta Cryst. C, 39 (1983) 1141.
31. F.H. Allen, O. Kennard, D.G. Watson, L. Brammer and A.G. Orpen, J. Chem. Soc. Perkin Trans., II (1987) S1-S19.
32. F.L. Hirshfeld, Acta Cryst. A, 32 (1976) 239.
33. W.R. Busing and H.A. Levy, Acta Cryst., 17 (1964) 142.
34. J. Griffiths and K.J. Pender, Dyes Pigments, 2 (1981) 37.
35. R. Taylor and O. Kennard, J. Am. Chem. Soc., 104 (1982) 5063.
36. M.J.S. Dewar, J. Chem. Soc. (1950) 2329.
37. K. Matsuoka, K. Ueda and T. Kitao, J. Jpn. Soc. Colour Mater. (SHIKIZAI), 55 (1982) 213 [in Japanese].
38. K.-Y. Chu and J. Griffiths, J. Chem. Research, (S) (1978) 180; J. Chem. Soc. Perkin I (1978) 696; 1083.
39. K.-Y. Chu and J. Griffiths, J. Chem. Research, (S) (1978) 180; J. Chem. Soc. Perkin I (1978) 696; 1083.
40. K.-Y. Chu and J. Griffiths, J. Chem. Research, (S) (1978) 180; J. Chem. Soc. Perkin I (1978) 696; 1083.
41. M.N. Burnett and C.K. Johnson, ORTEP-IV, Oak Ridge thermal ellipsoid plot program for crystal structure illustrations, ORNLA895, Oak Ridge Natl. Lab., Oak Ridge, TN, 1996.