Probing the relationships between mol-ecular conformation and inter-molecular contacts in N,N-dibenzyl-N′-(furan-2-carbonyl)-thio-urea

Acta Crystallographica Section C: Crystal Structure Communications

Volumn 68, Issue 1, 2012, Pages

  Pérez, Hiram ^a   Corra, Rodrigo S ^b   Plutín, Ana María ^a   Oreilly, Beatriz ^a   Andrade, Marcelo B ^c  

^a UNIVERSITY OF HAVANA   (Cuba)

^b FEDERAL UNIVERSITY OF SÃO CARLOS   (Brazil)

^c UNIVERSITY OF SÃO PAULO   (Brazil)

Author keywords

[No Author keywords available]

Indexed keywords

HYDROGEN BONDING MOTIFS; TITLE COMPOUNDS; ZIGZAG CHAINS;

CONFORMATIONS; HYDROGEN BONDS; METABOLISM; MOLECULAR STRUCTURE; UREA;

CRYSTAL STRUCTURE;

DRUG DERIVATIVE; FURAN DERIVATIVE; N,N DIBENZYL N' (FURAN 2 CARBONYL)THIOUREA; N,N-DIBENZYL-N'-(FURAN-2-CARBONYL)THIOUREA; THIOUREA;

ARTICLE; CHEMICAL STRUCTURE; CHEMISTRY; CONFORMATION; HYDROGEN BOND; MOLECULAR PROBE; X RAY CRYSTALLOGRAPHY;

CRYSTALLOGRAPHY, X-RAY; FURANS; HYDROGEN BONDING; MOLECULAR CONFORMATION; MOLECULAR PROBES; MOLECULAR STRUCTURE; THIOUREA;

EID: 84855436880     PISSN: 01082701     EISSN: 16005759     Source Type: Journal    
DOI: 10.1107/S0108270111052620     Document Type: Article

References (24)

1. Allen, F. H. (2002). Acta Cryst. B58, 380-388.
2. Bernstein, J., Davis, R. E., Shimoni, I. & Chang, N.-L. (1995). Angew. Chem. Int. Ed. Engl. 34, 1555-1573.
3. Binzet, G., Külcü, N., Flörke, U. & Arslan, H. (2009). J. Coord. Chem. 62, 3454-3462.
4. Coppens, P., Leiserowitz, L. & Rabinovich, D. (1965). Acta Cryst. 18, 1035-1038.
5. Corrêa, R. S., Estévez-Hernández, O., Ellena, J. & Duque, J. (2008). Acta Cryst. E64, o1414.
6. Enraf-Nonius (2000). COLLECT. Enraf-Nonius BV, Delft, The Netherlands.
7. Estévez-Hernández, O., Duque, J., Ellena, J. & Corrêa, R. S. (2008). Acta Cryst. E64, o1157.
8. Farrugia, L. J. (1997). J. Appl. Cryst. 30, 565.
9. Farrugia, L. J. (1999). J. Appl. Cryst. 32, 837-838.
10. Gomes, L. R., Santos, L. M. N. B. F., Coutinho, J. P., Schröder, B. & Low, J. N. (2010). Acta Cryst. E66, o870.
11. Hernández, W., Spodine, E., Muñoz, J. C., Beyer, L., Schröder, U., Ferreira, J. & Pavani, M. (2003). Bioinorg. Chem. Appl. 1, 271-284.
12. Macrae, C. F., Bruno, I. J., Chisholm, J. A., Edgington, P. R., McCabe, P., Pidcock, E., Rodriguez-Monge, L., Taylor, R., van de Streek, J. & Wood, P. A. (2008). J. Appl. Cryst. 41, 466-470.
13. McKinnon, J. J., Jayatilaka, D. & Spackman, M. A. (2007). Chem. Commun. 37, 3814-3816.
14. McKinnon, J. J., Mitchell, A. S. & Spackman, M. A. (1998). Chem. Eur. J. 4, 2136-2141.
15. Nagasawa, H. & Mitsunobu, O. (1981). Bull. Chem. Soc. Jpn, 54, 2223-2224.
16. Otwinowski, Z. & Minor, W. (1997). Methods in Enzymology, Vol. 276, Macromolecular Crystallography, Part A, edited by C. W. Carter Jr & R. M. Sweet, pp. 307-326. New York: Academic Press.
17. Pérez, H., Corrêa, R. S., Duque, J., Plutín, A. M. & O'Reilly, B. (2008). Acta Cryst. E64, m916.
18. Pérez, H., Corrêa, R. S., Plutín, A. M., Calderón, O. & Duque, J. (2009). Acta Cryst. E65, m242.
19. Pérez, H., Corrêa, R. S., Plutín, A. M., O'Reilly, B. & Duque, J. (2008). Acta Cryst. E64, m733-m734.
20. Pérez, H., Mascarenhas, Y., Plutín, A. M., de Souza Corrêa, R. & Duque, J. (2008). Acta Cryst. E64, m503.
21. Shanmuga Sundara Raj, S., Puviarasan, K., Velmurugan, D., Jayanthi, G. & Fun, H.-K. (1999). Acta Cryst. C55, 1318-1320.
22. Sheldrick, G. M. (2008). Acta Cryst. A64, 112-122.
23. Spackman, M. A. & Jayatilaka, D. (2009). CrystEngComm, 11, 19-32.
24. Wolff, S. K., Grimwood, D., McKinnon, J., Jayatilaka, D. & Spackman, M. A. (2005). CrystalExplorer. Version 2.1 (381). University of Western Australia, Australia.