Structure of a self-assembled chain of water molecules in a crystal host

Angewandte Chemie - International Edition

Volumn 42, Issue 15, 2003, Pages 1741-1743

  Pal, Satyanarayan ^a   Sankaran, N B ^a   Samanta, Anunay ^a  

^a UNIVERSITY OF HYDERABAD   (India)

Author keywords

Hydrogen bonds; Self assembly; Supramolecular chemistry; Water chemistry; X ray diffraction

Indexed keywords

HYDROGEN BONDS; MOLECULAR STRUCTURE; SELF ASSEMBLY; SUPRAMOLECULAR CHEMISTRY;

BIOLOGICAL ASSEMBLIES;

WATER;

ORGANIC COMPOUND; WATER;

ARTICLE; CRYSTALLIZATION; HYDROGEN BOND; PROTON TRANSPORT; SUPRAMOLECULAR CHEMISTRY; WATER STRUCTURE; X RAY CRYSTALLOGRAPHY; X RAY DIFFRACTION;

EID: 0037541272     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/anie.200250444     Document Type: Article

References (32)

1. D. Eisenberg, W. Kauzmann, The Structure and Properties of Water, Oxford University Press, New York, 1969.
2. R. Ludwig, Angew. Chem. 2001, 113, 1856; Angew. Chem. Int. Ed. 2001, 40, 1808.
3. R. Ludwig, Angew. Chem. 2001, 113, 1856; Angew. Chem. Int. Ed. 2001, 40, 1808.
4. F. N. Keutsch, R. J. Saykally, Proc. Natl. Acad. Sci. USA 2001, 98, 10533.
5. K. Liu, J. D. Cruzan, R. J. Saykally, Science 1996, 271, 929.
6. N. H. Fletcher, The Chemical Physics of Ice, Cambridge University Press, Cambridge, 1970.
7. M. Koza, H. Schober, A. Tölle, J. Fujara, T. Hansen, Nature 1999, 397, 660.
8. C. Lobban, J. L. Finney, W. F. Kuhs, Nature 1998, 391, 268.
9. R. Ludwig, ChemPhysChem 2000, 1, 53.
10. M. Matsumoto, S. Saito, I. Ohmine, Nature 2002, 416, 409.
11. J. M. Ugalde, I. Alkorta, J. Elguero, Angew. Chem. 2000, 112, 733; Angew. Chem. Int. Ed. 2000, 39, 717.
12. J. M. Ugalde, I. Alkorta, J. Elguero, Angew. Chem. 2000, 112, 733; Angew. Chem. Int. Ed. 2000, 39, 717.
13. K. Nauta, R. E. Miller, Science 2000, 287, 293.
14. J. L. Atwood, L. J. Barbour, T. J. Ness, C. L. Raston, P. L. Raston, J. Am. Chem. Soc. 2001, 123, 7192.
15. L. J. Barbour, G. W. Orr, J. L. Atwood, Nature 1998, 393, 671.
16. R. Custelcean, C. Afloroaei, M. Vlassa, M. Polverejan, Angew. Chem. 2000, 112, 3224; Angew. Chem. Int. Ed. 2000, 39, 3094.
17. R. Custelcean, C. Afloroaei, M. Vlassa, M. Polverejan, Angew. Chem. 2000, 112, 3224; Angew. Chem. Int. Ed. 2000, 39, 3094.
18. K. M. Park, R. Kuroda, T. Iwamoto, Angew. Chem. 1993, 105, 939; Angew. Chem. Int. Ed. Engl. 1993, 32, 884.
19. K. M. Park, R. Kuroda, T. Iwamoto, Angew. Chem. 1993, 105, 939; Angew. Chem. Int. Ed. Engl. 1993, 32, 884.
20. J. N. Moorthy, R. Natarajan, P. Venugopalan, Angew. Chem. 2002, 114, 3567; Angew. Chem. Int. Ed. 2002, 41, 3417.
21. J. N. Moorthy, R. Natarajan, P. Venugopalan, Angew. Chem. 2002, 114, 3567; Angew. Chem. Int. Ed. 2002, 41, 3417.
22. W. B. Blanton, S. W. Gordon-Wylie, G. R. Clark, K. D. Jordan, J. T. Wood, U. Geiser, T. J. Collins, J. Am. Chem. Soc. 1999, 121, 3551.
23. L. Infantes, S. Motherwell, CrystEngComm 2002, 4, 454.
24. The chosen molecule contains several secondary NH groups that mimic those present in biological systems (see for example, Water and Biological Macromolecules (Ed.: E. Westhoff), CRC Press, Boca Raton, FL, 1993.
25. -3. Even though a crystal structure of 1 was previously reported (J. H. Reibenspies, Acta Crystallogr. Sect. C 1992, 48, 1717), the arrangement of the water molecules in the crystal lattice was never examined. Moreover, the present crystallographic data show that ours is an improved structure that allows determination of the location of the water-hydrogen atoms more precisely. CCDC-195982 contains the supplementary crystallo-graphic data for this paper. These data can be obtained free of charge via www.ccdc.cam.ac.uk/conts/retrieving.html (or from the Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB21EZ, UK; fax: (+44) 1223-336-033; or deposit@ccdc.cam.ac.uk).
26. -3. Even though a crystal structure of 1 was previously reported (J. H. Reibenspies, Acta Crystallogr. Sect. C 1992, 48, 1717), the arrangement of the water molecules in the crystal lattice was never examined. Moreover, the present crystallographic data show that ours is an improved structure that allows determination of the location of the water-hydrogen atoms more precisely. CCDC-195982 contains the supplementary crystallo-graphic data for this paper. These data can be obtained free of charge via www.ccdc.cam.ac.uk/conts/retrieving.html (or from the Cambridge Crystallographic Data Centre, 12 Union Road, Cambridge CB21EZ, UK; fax: (+44) 1223-336-033; or deposit@ccdc.cam.ac.uk).
27. The corresponding oxygen atoms are representated as O3 in Figure 1 b.
28. S. X. Xantheas, T. H. Dunning, Jr., J. Chem. Phys. 1993, 99, 8774.
29. J. D. Cruzan, L. B. Braly, K. Liu, M. G. Brown, J. G. Loeser, R. J. Saykally, Science 1996, 271, 59.
30. M. Wikström, Curr. Opin. Struct. Biol. 1998, 8, 480.
31. M. Y. Okamura, M. L. Paddock, M. S. Graige, G. Feher, Biochim. Biophys. Acta 2000, 1458, 148.
32. D. Zaslavsky, R. B. Gennis, Biochim. Biophys. Acta 2000, 1458, 164.