Organic salts of biguanide - An attempt to crystal engineering of novel materials for second harmonic generation

Journal of Molecular Structure

Volumn 966, Issue 1-3, 2010, Pages 23-32

  Matulková, Irena ^a,b   Němec, Ivan ^b   Císařová, Ivana ^b   Němec, Petr ^b   Vaněk, Přemysl ^c  

^a J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY   (Czech Republic)

^b CHARLES UNIVERSITY   (Czech Republic)

^c INSTITUTE OF PHYSICS   (Czech Republic)

Author keywords

Biguanidium(1+) hydrogen succinate; Biguanidium(1+) oxalate hemihydrate; Biguanidium(2+) tartrate; Crystal structure; Second harmonic generation; Vibrational spectra

Indexed keywords

ANIONIC LAYERS; BASIS SETS; BIGUANIDIUM(1+) HYDROGEN SUCCINATE; BIGUANIDIUM(2+) TARTRATE; CARBOXYLATE GROUPS; FIRST HYPERPOLARIZABILITIES; FTIR AND FT-RAMAN SPECTRA; L-TARTARIC ACIDS; NOVEL MATERIALS; ORGANIC SALT; ORTHORHOMBIC SPACE GROUPS; QUANTITATIVE MEASUREMENT; RELATIVE EFFICIENCY; SECOND HARMONIC GENERATION; STRUCTURAL NETWORKS; TEMPERATURE INTERVALS; THEORETICAL VALUES; THERMAL BEHAVIOURS; TRICLINIC SPACE GROUP; WATER MOLECULE; X RAY STRUCTURAL ANALYSIS;

CARBOXYLATION; COMPLEXATION; DYES; FOURIER TRANSFORM INFRARED SPECTROSCOPY; HARMONIC ANALYSIS; HARMONIC GENERATION; HYDROGEN; HYDROGEN BONDS; INTERCONNECTION NETWORKS; NONLINEAR OPTICS; POSITIVE IONS; RAMAN SCATTERING; RAMAN SPECTROSCOPY; REFLECTION; SALTS; STRUCTURAL ANALYSIS; VIBRATIONAL SPECTRA;

CRYSTAL STRUCTURE;

EID: 75749100209     PISSN: 00222860     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molstruc.2009.11.061     Document Type: Article

References (33)

1. Boyd R.W., and Fischer G.L. Encyclopedia of Materials: Science and Technology (2001), Elsevier Science Ltd. (ISBN: 0-08-0431526, 6237-6244)
2. Aakeröy C.B., Hitchcock P.B., and Seddon K.R. J. Chem. Soc. Chem. Commun. 7 (1992) 553
3. Aakeröy C.B., Hitchcock P.B., Moyle B.D., and Seddon K.R. J. Chem. Soc. Chem. Commun. 23 (1989) 1856
4. Guru Row T.N. Coord. Chem. Rev. 183 (1999) 81
5. Hynes J.T. J. Phys. Chem. A 103 (1999) 3766
6. Martin A., Pinkerton A.A., and Schiemann A. Acta Cryst. C52 (1996) 966
7. Martin A., and Pinkerton A.A. Acta Cryst. C52 (1996) 1048
8. Pinkerton A.A., and Schwarzenbach D. J. Chem. Soc. Dalton (1978) 989
9. Ernst S.R. Acta Crystallogr., B: Struct. Crystallogr. Cryst. Chem. B33 (1977) 237
10. Matulková I., Němec I., Císařová I., Němec P., and Mička Z. J. Mol. Struct. 886 (2008) 103
11. Matulková I., Němec I., Císařová I., Němec P., and Mička Z. J. Mol. Struct. 873 (2008) 46
12. Bishop D.M., and Kirtman B. Phys. Rev. B 56 (1997) 2273
13. Castiglioni C., Del-Zoppo M., and Zerbi G. Phys. Rev. B 53 (1996) 13319
14. Castiglioni C., Del-Zoppo M., and Zerbi G. Phys. Rev. B 56 (1997) 2275
15. Bishop D.M., Champagne B., and Kirtman B. J. Chem. Phys. 109 (1998) 9987
16. Altomare A., Burla M.C., Camalli M., Cascarano G., Giacovazzo C., Guagliardi A., and Polidori G. SIR97 - J. Appl. Crystallogr. 27 (1994) 435
17. G.M. Sheldrick, SHELXL 97, Program for Refinement from Diffraction Data, University of Göttingen Germany, Göttingen, 1997.
18. Gaussian 03, Revision E.01, M.J. Frisch, G.W. Trucks, H.B. Schlegel, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, J.A. Montgomery, Jr., T. Vreven, K.N. Kudin, J.C. Burant, J.M. Millam, S.S. Iyengar, J. Tomasi, V. Barone, B. Mennucci, M. Cossi, G. Scalmani, N. Rega, G.A. Petersson, H. Nakatsuji, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, M. Klene, X. Li, J.E. Knox, H.P. Hratchian, J.B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R.E. Stratmann, O. Yazyev, A.J. Austin, R. Cammi, C. Pomelli, J.W. Ochterski, P.Y. Ayala, K. Morokuma, G.A. Voth, P. Salvador, J.J. Dannenberg, V.G. Zakrzewski, S. Dapprich, A.D. Daniels, M.C. Strain, O. Farkas, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Ortiz, Q. Cui, A.G. Baboul, S. Clifford, J. Cioslowski, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Komaromi, R.L. Martin, D.J. Fox, T. Keith, M.A. Al-Laham, C.Y. Peng, A. Nanayakkara, M. Challacombe, P. M.W. Gill, B. Johnson, W. Chen, M.W. Wong, C. Gonzalez, J.A. Pople, Gaussian, Inc., Wallingford CT, 2004.
19. Spek A.L. J. Appl. Cryst. 3 (2003) 7
20. Dinnebier R.E., Vensky S., Panthöfer M., and Jansen M. Inorg. Chem. 42 (2003) 1499
21. Cambridge Structural Database, ConQuest Version 1.11, Entries in CSD version 5.30 (November 2008), .
22. Matulková I., Němec I., Císařová I., Němec P., and Mička Z. J. Mol. Struct. 834 (2007) 328
23. Socrates G. Infrared and Raman Characteristic Group Frequencies (Tables and Charts) (2001), John Wiley and sons, Baffins Lane, Chichester, West Sussex, England p. 125
24. Bock C.W., and Redington R.L. J. Chem. Phys. 85 10 (1986) 5391
25. De Villepin J., Novak A., and Bougeard D. Chem. Phys. 73 (1982) 291
26. Tarakeshwar P., and Manogaran S. J. Mol. Struct. (Theochem) 362 (1996) 77
27. Debrus S., Marchewka M.K., Baran J., Drozd M., Czopik R., Pietraszko A., and Ratajczak H. J. Solid. State Chem. 178 (2005) 2880
28. Salah M.B., Mouaïne K., Becker P., and Carabatos-Nédelec C. Phys. Status Solidi (b) 220 (2000) 1025
29. Kolandaivel P., and Selvasekarapandian S. Cryst. Res. Technol. 28 5 (1993) 665
30. Marchewka M.K., Ratajczak H., and Debrus S. J. Nonlinear Opt. Phys. Mater. 12 1 (2003) 113
31. Novak A. Struct. Bond. 18 (1973) 177
32. Lautié A., Froment F., and Novak A. Spectrosc. Lett. 9 (1976) 289
33. Thanthiriwatte K.S., and Nalin de Silva K.M. J. Mol. Struct. (Theochem) 617 (2002) 169