A comparative study on hydrogen bonding ability of thioformohydroxamic acid and formohydroxamic acid

Journal of Molecular Structure: THEOCHEM

Volumn 864, Issue 1-3, 2008, Pages 72-79

  Kaur, Damanjit ^a   Kohli, Ruchi ^a   Kaur, Rupinder Preet ^a  

^a GURU NANAK DEV UNIVERSITY   (India)

Author keywords

Aggregates; Hydrogen bonding; Interaction energy; Tautomers; Thiohydroxamic acid

Indexed keywords

EID: 49149089773     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2008.06.008     Document Type: Article

References (57)

1. Lehn J.-M. Supramolecular Chemistry (1995), VCH, Weiheim, Germany
2. Steed J.W., and Atwood J.L. Supramolecular Chemistry (2000), Wiley, New York
3. Rablen P.R., Lockman J.W., and Jorgensen W.L. J. Phys. Chem. A 102 (1998) 3782
4. Grabowski S.J. J. Phys. Chem. A 105 (2001) 10739
5. Taylor R., and Kennard O. J. Am. Chem. Soc. 104 (1982) 5063
6. Alkorta I., and Rozas I. Elguero. J. Chem. Soc. Rev. 27 (1998) 163
7. Desiraju G.R. Acc. Chem. Res. 29 (1996) 441
8. Kariuki B.M., Harris K.D.M., Philp D., and Robinson J.M.A. J. Am. Chem. Soc. 119 (1997) 12679
9. Huque F.T.T., and Platts J.A. Org. Biomol. Chem. 1 (2003) 1419
10. Leahy D.E., Morris J.J., Taylor P.J., and Wait A.R. J. Chem. Soc. Perkin Trans. 2 (1992) 705
11. Spange S., and Reuter A. Langmuir 15 (1999) 141
12. Scheiner S., Kar T., and Pattanayak J. J. Am. Chem. Soc. 124 (2002) 13257
13. Platts J.A., Howard S.T., and Bracke B.R.F. J. Am. Chem. Soc. 118 (1996) 2726
14. Sennikov P.G. J. Phys. Chem. 98 (1994) 4973
15. Legon A.C., and Millen D.J. J. Am. Chem. Soc. 109 (1987) 356
16. Min B.K., Lee H.J., Choi Y.S., Park J., Yoon C.J., and Yu J.A. J. Mol. Struct. 471 (1998) 283
17. Shaw R.A., Kollat E., Hollosi M., and Mantsch H.H. Spectrochim. Acta 51A (1995) 1399
18. Sherman D.B., and Spatola A.F. J. Am. Chem. Soc. 112 (1990) 433
19. Ueyama N., Yamada Y., Okamura T., Kimura S., and Nakamura A. Inorg. Chem. 35 (1996) 6473
20. Poulos T.L., Finzel B.C., and Howard A.J. J. Mol. Biol. 195 (1987) 687
21. Ueno T., Nishikawa N., Moriyama S., Adachi S., Lee K., Okamura T., Ueyama N., and Nakamura A. Inorg. Chem. 38 (1999) 1199
22. Ueyama N., Terekawa T., Nakata M., and Nakamura A. J. Am. Chem. Soc. 105 (1983) 7098
23. Yen S.J., and Ho J.J. J. Phys. Chem. A 104 (2000) 8551
24. Orita Y., Ando A., Abe H., Yamabe S., Berthod H., and Pullman A. Theor. Chim. Acta (Ber) 54 (1979) 83
25. Winkelmann G., Helm V.D., and Neilands J.B. Iron Transport in Microbes, Plants and Animals (1987), VCH, Weinheim, New York
26. Egawa Y., Umino K., Ito Y., and Okuda T. J. Antibiot. 24 (1971) 124
27. Itoh S., Inuzuka K., and Suzuki T. J. Antibiot. 23 (1970) 542
28. Walter W., and Schaumann E. Synthesis 3 (1971) 111
29. Mitchell A., Murray K.S., Newman P.J., and Clark P.E. Aust. J. Chem. 30 (1977) 2439
30. Chimiak A., Przychodzen W., and Rachon J. Heteroat. Chem. 13 (2002) 169
31. Kakkar R., Dua A., and Zaidi S. Org. Biomol. Chem. 5 (2007) 547
32. Kaczor A., and Proneiewicz L.M. J. Mol. Struct. Theochem. 640 (2003) 133
33. Nino A., Caro C.M., and Senent M.L. J. Mol. Struct. Theochem. 530 (2000) 291
34. Bond A.D., and Jones W. J. Phys. Org. Chem. 13 (2000) 395
35. Austin P.W., and Singer M. United States Patent (1996) 5500217
36. Jensen K.A., Buchardt O., and Christophersen C. Acta Chem. Scand. 21 (1967) 1936
37. Nagata K., and Mizukami S. Chem. Pharm. Bull. 14 (1966) 1255
38. M.J. Frisch, G.W Trucks, H.B. Schlegal, G.E. Scuseria, M.A. Robb, J.R. Cheeseman, V.G. Zarkrzewski, J.A. Montgomery Jr., R.E. Stratmann, J.C. Burant, S. Dapprich, J.M. Millam, A.D. Daniels, K.N. Kudinm, M.C. Strain, O. Farkas, J. Tomasi, V. Baroni, M. Cossi, R. Cammi, B. Mennuci, C. Pomelli, C. Adamo, S. Clifford, J. Ochterski, G.A. Petersson, P.Y. Ayala, Q. Cui, K. Morokuma, N. Rega, P. Salvador, J.J. Dannenberg, D.K. Malick, A.D. Rabuck, K. Raghavachari, J.B. Foresman, J.V. Oritz, A.G. Baboul, B.B. Stefanov, G. Liu, A. Liashenko, P. Piskorz, I. Kamaromi, R. Gomperts, 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, J.L. Andres, C. Gonzalez, M. Head-Gordon, E.S. Replogle, J.A. Pople, Gaussian 98, Revision-A.11.2, Gaussian Inc. Pittsburgh, PA, 2001.
39. Hehre W.J., Radom L., Schleyer P.V.R., and Pople J.A. Ab Initio Molecular Orbital Theory (1986), Wiley, New York
40. J.B. Forseman, E. Frisch, Exploring Chemistry with Electronic Structure Methods, Pittsburgh, PA, Gaussian Inc., 1996.
41. Sinha P., Boesch S.E., Gu C., Wheeler R.A., and Wilkon A.K. J. Phys. Chem. A 108 (2004) 9213
42. Reed A.E., Weinstock R.B., and Weinhold F. J. Chem. Phys. 83 (1985) 735
43. Reed A.E., Curtiss L.A., and Weinhold F. Chem. Rev. 88 (1988) 899
44. Boys S.F., and Bernardi F. Mol. Phys. 19 (1970) 553
45. Saldyka M., and Mielke Z. Chem. Phys. 308 (2005) 59
46. Kaur D., and Kohli R. Int. J. Quantum Chem. 108 (2008) 119
47. Desiraju G.R., and Steiner T. The Weak Hydrogen Bond in Structural Chemistry and Biology (1999), Oxford University Press, Oxford
48. Bader R.F.W. Atoms in Molecules: A Quantum Theory (1990), Oxford University Press, Oxford
49. Cioslowski J., Nanayakkara A., and Challacombe M. Chem. Phys. Lett. 203 (1993) 137
50. Cioslowski J., and Surjan P.R. J. Mol. Struct. 255 (1992) 9
51. Cioslowski J., and Stefanov B.B. Mol. Phys. 84 (1995) 707
52. Stefanov B.B., and Cioslowski J.R. J. Comp. Chem. 16 (1995) 1394
53. Cioslowski J. Int. J. Quant. Chem. Quant. Chem. Symp. 24 (1990) 15
54. Cioslowski J., and Mixon S.T. J. Am. Chem. Soc. 113 (1991) 4142
55. Cioslowski J. Chem. Phys. Lett. 194 (1992) 73
56. Cioslowski J. Chem. Phys. Lett. 219 (1994) 151
57. L. Williams. Available from: .