Synthesis, structural and spectroscopic study of the donor-acceptor complexes between fluorene and D2h cyano molecular building blocks

CrystEngComm

Volumn 5, Issue , 2003, Pages 388-394

  Arrais, Aldo ^a   Boccaleri, Enrico ^a   Croce, Gianluca ^a   Milanesio, Marco ^a   Orlando, Roberto ^a   Diana, Eliano ^b  

^a UNIVERSITY OF EASTERN PIEDMONT   (Italy)

^b UNIVERSITY OF TURIN   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

1,2,4,5 TETRACYANOBENZENE; 7,7,8,8 TETRACYANOQUINODIMETHANE; BENZENE DERIVATIVE; FLUORENE; METHANE; TETRACYANOETHYLENE; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; CLUSTER ANALYSIS; COMPLEX FORMATION; CRYSTAL STRUCTURE; DONOR; ELECTRON; ENERGY; EXPERIMENTATION; INFRARED RADIATION; MOLECULE; QUANTUM THEORY; RAMAN SPECTROMETRY; SOLID STATE; SPECTROSCOPY; STRUCTURE ANALYSIS; SYNTHESIS; X RAY DIFFRACTION;

EID: 4143145114     PISSN: 14668033     EISSN: None     Source Type: Journal    
DOI: 10.1039/b308380b     Document Type: Article

References (36)

1. R. L. Hummel and K. Ruedenberg, J. Phys. Chem., 1962, 66, 2334.
2. S. Siegel and H. S. Judeikis, J. Phys. Chem., 1966, 70, 2205.
3. A. Bree and R. Zwarich, J. Chem. Phys., 1969, 51, 903.
4. Nanotechnology: Molecularly Designed Materials, ed. G.-M. Chow and K. E. Gonsalves, ACS Symp. Series no. 622, American Chemical Society, Washington, DC, 1996, p. 424.
5. Materials for Nonlinear Optics: Chemical Perspectives, ed. S. R. Marder, J. E. Sohn and G. D. Stucky, ACSI Symp. Ser., American Chemical Society, Washington, DC, 1991, p. 455.
6. E. Umbach, M. Sokolowski and R. Fink, Appl. Phys. A, 1996, 63, 565.
7. M. Munakata, L. P. Wu and G. L. Ning, Coord. Chem. Rev., 2000, 198, 171.
8. R. Atencio, K. V. Domasevitch and M. J. Zaworotko, Cryst. Eng., 2000, 3, 63.
9. D. V. S. Muthu, M. N. Shashikala, A. K. Sood, R. Seshadri and C. N. R. Rao, Chem. Phys. Lett., 1994, 217, 146.
10. K. Tanaka, T. Sato and T. Yamabe, J. Phys. Chem., 1996, 100, 3980.
11. F. H. Allen, Acta Crystallogr., 2002, B58, 380.
12. Hertel Romer, Z. Phys. Chem. (Leipzig), 1930, B11, 77.
13. F. H. Herbstein, M. Kaftory and H. Regev, J. Appl. Crystallogr., 1976, 9, 361.
14. R. A. Mariezcurrena, S. Russi, A. W. Mombrú, L. Suescun, H. Pardo, O. L. Tombesi and M. A. Frontera, Acta Crystallogr., Sect. C, 1999, 55, 1170.
15. W. Muhle, J. Krzystek, J. U. Schutz, H. C. Wolf, R. D. Stigler and J. J. Stezowski, Chem. Phys., 1986, 108, 1.
16. Y. Wang, J. Phys. Chem., 1992, 96, 764.
17. A. Arrais, E. Diana, R. Gobetto, M. Milanesio, D. Viterbo and P. L. Stanghellini, Eur. J. Inorg. Chem., 2003, 6, 1186.
18. V. R. Saunders, R. Dovesi, C. Roetti, M. Causà, N. M. Harrison, R. Orlando and C. M. Zicovich-Wilson, CRYSTAL-98 User's Manual, Università di Torino, Torino, 1999.
19. G. Croce, A. Arrais, E. Diana, B. Civalleri, D. Viterbo and M. Milanesio, accepted for publication in Int. J. Mol. Sci.
20. Complete crystallographic information on compounds 1, 2 and 3 has been deposited by the CCDC with deposition numbers CCDC-215462, CCDC-215463 and CCDC-215464, respectively.
21. G. M. Sheldrick, SADABS, University of Göttingen, Germany, 1996.
22. A. Altomare, M. C. Burla, M. Camalli, G. L. Cascarano, C. Giacovazzo, A. Guagliardi, A. G. Moliterni, G. Polidori and R. Spagna, J. Appl. Crystallogr., 1999, 32, 115, web site: http://www.irmec.ba.cnr.it/.
23. G. M. Sheldrick, SHELXL-97, University of Göttingen, Germany, 1997, web site: http://shelx.uni-ac.gwdg.de/SHELX/.
24. 26 format.
25. SHELXTL, © 1998-2003, Bruker AXS, Inc., Madison, WI, 1998.
26. P. Ugliengo, D. Viterbo and G. Chiari, Z. Kristallogr., 1993, 207, 9.
27. The exponents of the valence basis functions have been scaled by a factor of 1.1 to improve the SCF convergence.
28. W. J. Hehre, L. Radom, P. v. R. Schleyer and J. A. Pople, Ab initio molecular orbital theory, Wiley, New York, 1986.
29. Jaguar 4.1. (4.1), Schrödinger Inc, Portland, OR, 2000.
30. A. D. Becke, J. Chem. Phys., 1993, 98, 5648.
31. C. Lee, W. Yang and R. G. Parr, Phys. Rev. B: Condens. Matter, 1988, 37, 785.
32. E. Diana, R. Rossetti and P. L. Stanghellini, Mater. Chem. Phys., 1991, 29, 333.
33. J. Umemura, L. V. Haley, D. G. Cameron, W. F. Murphy, C. F. Ingold and D. F. Williams, Spectrochim. Acta, 1981, 37A, 835.
34. E. Diana, R. Rossetti, P. L. Stanghellini and S. F. A. Kettle, Inorg. Chem., 1997, 36, 382.
35. D. M. Hudgins and L. J. Allamandola, J. Phys. Chem. A, 1997, 101, 3472.
36. H. Fujita, H. Fujimori and M. Oguni, J. Chem. Thermodyn., 1995, 27, 927.