A DFT study on supramolecular interaction between halide anion and o-di(pyrrolyl-2-formamido)phenylene in DMSO

Acta Chimica Sinica

Volumn 65, Issue 21, 2007, Pages 2377-2381

  Pan, Guo Xiang ^a   Ni, Zhe Ming ^a   Wang, Li Geng ^a   Li, Xiao Nian ^a  

^a ZHEJIANG UNIVERSITY OF TECHNOLOGY   (China)

Author keywords

Anion recognition; Density functional theory; O di(pyrrolyl 2 formamido)phenylene

Indexed keywords

EID: 84880776910     PISSN: 05677351     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (22)

1. Schmidtchen F. P, Berger M. Chem. Rev. 1997 97 1609.
2. Martinez-Manez R, Sancenon F. Chem. Rev. 2003 103 4419.
3. Kim S. K, Singh N. J, Kwon J, Hwang I. C, Park S. J, Kim K. S; Yoon J. Tetrahedron 2006 62 6065.
4. Pan G.-X, Ni Z.-M, Wang L. G. Acta Chim. Sinica 2007 65 385 (in Chinese).
5. Frontera A, Morey J, Oliver A, Pina M. N, Quinonero D, Costa A, Ballester P, Deya P. M, Anslyn E. V. J. Org. Chem. 2006 71 7185.
6. Li F, Delgado R, Felix V. Euro. J. Inorg. Chem. 2005 22 4550.
7. Gale P. A, Anzenbacher P, Sessler J. L. Coord. Chem. Rev. 2001 222 57.
8. Sessler J. L, Davis J. M, Kral V, Kimbrough T, Lynch V. Org. Biomol. Chem. 2003 1 4113.
9. Sessler J. L, Maeda H, Mizuno T, Lynch V. M, Furuta H. Chem. Commun. 2002 223 862.
10. Gale P. A, Camiolo S, Tizzard G. J, Chapman C. P, Light M. E, Coles S. J, Hursthouse M. B. J. Org. Chem. 2001 66 7849.
11. Yin Z. M, Li Z. C, Yu A, He J. Q, Cheng J. P. Tetrahedron Lett. 2004 45 6803.
12. Yin Z.-M, He J.-Q, Cheng J.-P. Chem. J. Chin. Univ. 2006 27 871 (in Chinese).
13. Yin Z.-M, Yan W.-Z, He J.-Q, Cheng J.-P. Chem. J. Chin. Univ. 2004 25 1260 (in Chinese).
14. Becke A. D. J. Chem. Phys. 1993 98 5648.
15. Lee C, Yang W, Parr R. G. Phys. Rev. 1988 37B 785.
16. Hay P. J, Wadt W. R. J. Chem. Phys. 1985 82 270.
17. Pichierri F. J. Mol. Struct. Theochem. 2002 581 117.
18. Tapia O, Goscinski O. Mol. Phys. 1975 29 1653.
19. Hill T. L. Introduction to Statistical Thermodynamics, Addision- Wesley Publishing Company, New York, 1960.
20. Frisch M. J, Trucks G. W, Schlegel H. B, Scuseria G. E, Robb M. A, Cheeseman J. R, Montgomery J. A, Vreven T. Jr, Kudin K. N, Burant J. C, Millam J. M, Iyengar S. S, Tomasi J, Barone V, Mennucci B, Cossi M, Scalmani G, Rega N, Petersson G. A, Nakatsuji H, Hada M, Ehara M, Toyota K, Fukuda R, Hasegawa J, Ishida M, Nakajima T, Honda Y, Kitao O, Nakai H, Klene M, Li X, Knox J. E, Hratchian H. P, Cross J. B, Adamo C, Jaramillo J, Gomperts R, Stratmann R. E, Yazyev O, Austin A. J, Cammi R, Pomelli C, Ochterski J. W, Ayala P. Y, Morokuma K, Voth G. A, Salvador P, Dannenberg J. J, Zakrzewski V. G, Dapprich S, Daniels A. D, Strain M. C, Farkas O, Malick D. K, Rabuck A. D, Raghavachari K, Foresman J. B, Ortiz J. V, Cui Q, Baboul A. G, Clifford S, Cioslowski J, Stefanov B. B, Liu G, Liashenko A, Piskorz P, Komaromi I, Martin R. L, Fox D. J, Keith T, Al-Laham M. A, Peng C. Y, Nanayakkara A, Challacombe M, Gill P. M. W, Johnson B, Chen W, Wong M. W, Gonzalez C, Pople J. A. Gaussian 03 Revision B. 01, Gaussian, Inc., Pittsburgh PA, 2003.
21. Chen P.-Q, Sun H.-W, Chen L, Shen R.-X, Yuan M.-X, Lai C.-M, Li Z.-M. Acta Chim. Sinica 2005 63 1175 (in Chinese).
22. Boys F, Bernardi F. Mol. Phys. 1970 19 553.