Multiple proton donors on BeH2⋯2HCl trimolecular dihydrogen-bonded complex: Some theoretical insights

Structural Chemistry

Volumn 19, Issue 4, 2008, Pages 665-670

  Oliveira, Boaz G ^a   Araújo, Regiane C M U ^a   Ramos, Mozart N ^b  

^a FEDERAL UNIVERSITY OF PARAÍBA   (Brazil)

^b FEDERAL UNIVERSITY OF PERNAMBUCO   (Brazil)

Author keywords

Bimolecular; Dihydrogen bonds; Proton donors; Trimolecular

Indexed keywords

EID: 49249138659     PISSN: 10400400     EISSN: None     Source Type: Journal    
DOI: 10.1007/s11224-008-9344-5     Document Type: Article

References (43)

1. TW Martin ZS Derewenda 1999 Nat Struct Biol 6 403 406 10.1038/8195
2. S Pol PK Maiti B Bagchi 2006 J Chem Phys 125 234903 234911 10.1063/1.2403872
3. K Narayan C-L Chou A Kim IZ Hartman S Dalai S Khoruzhenko 2006 Nat Immun 8 92 100 10.1038/ni1414
4. Chen B, Ivanov I, Klein ML, Parrinello M (2003) Phys Rev Lett 91:215503-3-215503-4
5. PT Muthiah JJ Robert SB Raj G Bocelli R Ollá 2001 Acta Crystallogr E57 m558 m560
6. BG Oliveira RCMU Araújo AB Carvalho EF Lima WLV Silva MN Ramos 2006 J Mol Struct Theochem 775 39 45 10.1016/j.theochem.2006.06.028
7. Pimentel GC, McClelan AC (1960) The hydrogen bonding. Freeman, San Francisco
8. B Barbiellini A Shukla 2000 Phys Rev B 66 235101 235105 10.1103/PhysRevB.66.235101
9. T Kar S Scheiner 2003 J Chem Phys 119 1473 1482 10.1063/1.1580093
10. Ikorta I, Elguero J, Foces-Foces C (1996) Chem Commun 1633-1634
11. W Zierkiewicz P Hobza 2004 Phys Chem Chem Phys 6 5288 5296 10.1039/b410112j
12. SJ Grabowski TL Robinson J Leszczynski 2004 Chem Phys Lett 108 44 48 10.1016/j.cplett.2004.01.013
13. MG Govender TA Ford 2003 J Mol Struct Theochem 630 11 16 10.1016/S0166-1280(03)00145-3
14. D Hugas S Simon M Duran 2005 Struct Chem 16 257 263 10.1007/s11224-005- 4456-7
15. M Solimannejad I Alkorta 2006 Chem Phys 324 459 464 10.1016/j.chemphys. 2005.11.007
16. T Richardson S de Gala RH Crabtree PEM Siegbahn 1995 J Am Chem Soc 117 12875 12876 10.1021/ja00156a032
17. J Wessel JC Lee Jr E Peris GPA Yap JB Fortin JS Ricci 1995 Angew Chem Int Ed Engl 34 2507 2509 10.1002/anie.199525071
18. SJ Grabowski 2000 J Phys Chem A 104 5551 5557 10.1021/jp993984r
19. PLA Popelier 1998 J Phys Chem A 102 1873 1878 10.1021/jp9805048
20. BS Jursic 1998 J Mol Struct Theochem 434 37 42 10.1016/S0166-1280(98) 00086-4
21. R Custelcean JE Jackson 1998 J Am Chem Soc 120 12935 12941 10.1021/ja982959g
22. AH Pakiari A Mohajeri 2003 J Mol Struct Theochem 620 31 36 10.1016/S0166-1280(02)00580-8
23. AH Pakiari A Mohajeri 2004 J Mol Struct Theochem 685 155 161 10.1016/j.theochem.2004.06.053
24. Bader RFW (1990) Atoms in molecules. A quantum theory. Oxford University Press, New York
25. RFW Bader PJ MacDougall CD Lau 1984 J Am Chem Soc 106 1594 1605 10.1021/ja00318a009
26. I Rozas I Alkorta J Elguero 1997 J Phys Chem A 101 9457 9463 10.1021/jp971893t
27. Oliveira BG, Araújo RCMU, Carvalho AB, Ramos, MN (2007) J Theor Comp Chem 6:647-660
28. M Rozenberg A Loewenschuss Y Marcus 2000 ChemPhysChem 2 2699 2702
29. P Hobza Z Havlas 2000 Chem Rev 1000 4253 4264 10.1021/cr990050q
30. W Yu Z Lin Z Huang 2006 ChemPhysChem 7 828 830 10.1002/cphc.200500721
31. Frisch MJ et al (1998) Gaussian 98W (Revision A.1). Gaussian, Inc., Pittsburgh, PA
32. AIM (2000) 1.0 designed by Biegler-König F. University of Applied Sciences, Bielefeld, Germany
33. van Meerssche M, Feneau-Dupont J (1976) Introduction à la Cristallographie et à la Chimie Structurale. OYEZ, Leuven
34. Caballero A, Jalón FA, Manzano BR (1998) Chem Commun 1879-1880
35. SF Boys F Bernardi 1970 Mol Phys 19 553 566 10.1080/00268977000101561
36. J Wu J Zhang Z Wang W Cao 2007 Chem Phys 338 69 74 10.1016/j.chemphys. 2007.07.043
37. W Wang W Zheng X Pu N-B Wong A Tian 2002 J Mol Struct Theochem 618 235 244 10.1016/S0166-1280(02)00543-2
38. GN Patwari E Takayuki MM Naohiko 2000 J Chem Phys 113 9885 9888 10.1063/1.1330234
39. X Wang L Andrews L Gagliardi 2008 J Phys Chem A 112 1754 1761 10.1021/jp710326k
40. BG Oliveira RCMU Araújo MN Ramos 2008 Struct Chem 19 185 189
41. BG Oliveira RCMU Araújo 2007 Quim Nova 30 791 796
42. RCMU Araújo MN Ramos 1996 J Mol Struct Theochem 366 233 240 10.1016/0166-1280(96)04536-8
43. RCMU Araújo MN Ramos 1998 J Braz Chem Soc 9 499 505