SCOPUS 정보 검색 플랫폼

Journal of Molecular Structure: THEOCHEM

Volumn 594, Issue 3, 2002, Pages 135-145

A density functional study of alizarin two of its isomers and its transition metals and rare-earth complexes

(3) Komiha, N a Kabbaj, O K a Chraibi, M a

Author keywords

Alizarin; Complexation energy; Density functional theory; Dihydroxyanthraquinone; Rare earth complexes; Transition metal complexes

Indexed keywords

ALIZARIN; ALUMINUM; ANTHRAQUINONE; CHROMIUM; METAL; OXYGEN; ZINC;

ARTICLE; CHELATION; CHEMICAL BOND; COLOR; COMPLEX FORMATION; CONFORMATION; DRUG BINDING; DRUG STRUCTURE; ELECTROCHEMICAL ANALYSIS; ENERGY; ISOMER; METAL BINDING; STRUCTURE ANALYSIS;

EID: 0037131109 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(02)00140-9 Document Type: Article

Times cited : (30)

References (50)

1
- 37049130310
- M. Ahmed, A.K. Davies, G.O. Phillips, J.T. Richards, J. Chem. Soc., Perkin Trans. II (1973) 1386.
- (1973) J. Chem. Soc., Perkin Trans. II , pp. 1386
- Ahmed, M.¹ Davies, A.K.² Phillips, G.O.³ Richards, J.T.⁴

2
- 0018109876
- N.S. Allen, J.F. McKellar, J. Polym. Sci., Macromol. Rev. 13 (1978) 241.
- (1978) J. Polym. Sci., Macromol. Rev. , vol.13 , pp. 241
- Allen, N.S.¹ McKellar, J.F.²

3
- 0019376372
- H.M. Berman, P.R. Young, Annu. Rev. Biophys. Bioengng 10 (1981) 87.
- (1981) Annu. Rev. Biophys. Bioengng. , vol.10 , pp. 87
- Berman, H.M.¹ Young, P.R.²

4
- 0003569570
- Oxford University Press, New York
- R.G. Parr, W. Yang, Density Functional Theory of Atoms and Molecules, Oxford University Press, New York, 1989.
- (1989) Density Functional Theory of Atoms and Molecules
- Parr, R.G.¹ Yang, W.²

5
- 10644250257
- P. Hohenberg, W. Kohn, Phys. Rev. B 136 (1964) 864.
- (1964) Phys. Rev. B , vol.136 , pp. 864
- Hohenberg, P.¹ Kohn, W.²

6
- 37049086518
- C.A. Reynolds, Annu. Rep. Chem. Soc. (B) 90 (1993) 51.
- (1993) Annu. Rep. Chem. Soc. (B) , vol.90 , pp. 51
- Reynolds, C.A.¹

7
- 0004133516
- Gaussian Inc., Pittsburgh, PA
- GAUSSIAN 94, Revision D.3, Gaussian Inc., Pittsburgh, PA, 1995.
- (1995) GAUSSIAN 94, Revision D.3

8
- 0010733436
- Biosym Technologies, San Diego
- DEMON, Version 1.0 beta, Biosym Technologies, San Diego, 1992.
- (1992) DEMON, Version 1.0 beta

9
- 0000216001
- S.H. Vosko, L, Wilk, M. Nusair, Can. J. Phys. 58 (1980) 1200.
- (1980) Can. J. Phys. , vol.58 , pp. 1200
- Vosko, S.H.¹ Wilk, L.² Nusair, M.³

10
- 18144378706
- J.P. Perdew, Y. Wang, Phys. Rev. B 33 (1986) 8800.
- (1986) Phys. Rev. B , vol.33 , pp. 8800
- Perdew, J.P.¹ Wang, Y.²

11
- 4243553426
- A.D. Becke, Phys. Rev. A 38 (1988) 3098.
- (1988) Phys. Rev. A , vol.38 , pp. 3098
- Becke, A.D.¹

12
- 5944261746
- J.P. Perdew, Phys. Rev. B 33 (1986) 8822.
- (1986) Phys. Rev. B , vol.33 , pp. 8822
- Perdew, J.P.¹

13
- 0345491105
- C. Lee, W. Yang, R.G. Parr, Phys. Rev. B 37 (1988) 785.
- (1988) Phys. Rev. B , vol.37 , pp. 785
- Lee, C.¹ Yang, W.² Parr, R.G.³

14
- 0010649488
- B.I. Dunlap, Phys. Rev. A 25 (1982) 2847.
- (1982) Phys. Rev. A , vol.25 , pp. 2847
- Dunlap, B.I.¹

15
- 84987063960
- V.R. Saunders, H.I. Hillier, Int. J. Quantum Chem, 7 (1973) 699.
- (1973) Int. J. Quantum Chem. , vol.7 , pp. 699
- Saunders, V.R.¹ Hillier, H.I.²

16
- 0000799692
- J.C. Barthelat, Ph. Durand, Gazetta Chim. Italiana 108 (1978) 225.
- (1978) Gazetta Chim. Italiana , vol.108 , pp. 225
- Barthelat, J.C.¹ Durand, P.H.²

17
- 33646667685
- Ph. Durand, J.C. Barthelat, Theor. Chem. Acta 38 (1975) 283.
- (1975) Theor. Chem. Acta , vol.38 , pp. 283
- Durand, Ph.¹ Barthelat, J.C.²

18
- 0001102761
- P.A.B. Marasinghe, G.D. Gillispie, Chem. Phys. 136 (1989) 249.
- (1989) Chem. Phys. , vol.136 , pp. 249
- Marasinghe, P.A.B.¹ Gillispie, G.D.²

19
- 0010690133
- J.D. Petke, P. Butler, G.M. Maggiora, Int. J. Quant. Chem. 27 (1995) 7.
- (1995) Int. J. Quant. Chem. , vol.27 , pp. 7
- Petke, J.D.¹ Butler, P.² Maggiora, G.M.³

20
- 0010692309
- I. Frank, S. Grimme, S.D. Peyerimhoff, Chem. Phys. 103 (1) (1995) 219.
- (1995) Chem. Phys. , vol.103 , Issue.1 , pp. 219
- Frank, I.¹ Grimme, S.² Peyerimhoff, S.D.³

21
- 0001341897
- G.D. Niggam, B. Deppisch, Z. Krist. 151 (1980) 185.
- (1980) Z. Krist. , vol.151 , pp. 185
- Niggam, G.D.¹ Deppisch, B.²

22
- 0000543828
- I. Frank, D. Marx, M. Parinello, J. Chem. Phys. 104 (20) (1996) 8143.
- (1996) J. Chem. Phys. , vol.104 , Issue.20 , pp. 8143
- Frank, I.¹ Marx, D.² Parinello, M.³

23
- 84975646237
- B. Sauter, C. Brauchle, J. Opt. Soc. Am. B 9 (1992) 804.
- (1992) J. Opt. Soc. Am. B , vol.9 , pp. 804
- Sauter, B.¹ Brauchle, C.²

24
- 85045814135
- L.W. Johnson, M.A. Savory, C. Pope, M. Foresti, J.R. Lombardi, J. Chem. Phys. 86 (1987) 3048.
- (1987) J. Chem. Phys. , vol.86 , pp. 3048
- Johnson, L.W.¹ Savory, M.A.² Pope, C.³ Foresti, M.⁴ Lombardi, J.R.⁵

25
- 0010649922
- L. Kummerl, H.W. Wolfrum, D. Haarer, J. Phys. Chem. 96 (1992) 10688.
- (1992) J. Phys. Chem. , vol.96 , pp. 10688
- Kummerl, L.¹ Wolfrum, H.W.² Haarer, D.³

26
- 0343400773
- A. DelMedico, S.C. Fielder, A.B.P. Lever, W.J. Pietro, Inorg. Chem. 34 (1995) 1507.
- (1995) Inorg. Chem. , vol.34 , pp. 1507
- DelMedico, A.¹ Fielder, S.C.² Lever, A.B.P.³ Pietro, W.J.⁴

27
- 0019376372
- H.M. Berman, P.R. Young, Annu. Rev. Biophys. Bioengng 10 (1981) 87.
- (1981) Annu. Rev. Biophys. Bioengng. , vol.10 , pp. 87
- Berman, H.M.¹ Young, P.R.²

28
- 0026311441
- J. Mateju, M. Nohynek, Folia Mocrobiol. 36 (3) (1991) 314.
- (1991) Folia Mocrobiol. , vol.36 , Issue.3 , pp. 314
- Mateju, J.¹ Nohynek, M.²

29
- 0027090245
- L.E. Thornell, B. Holmbom, A. Eriksson, S. Reiz, S. Marklund, U. Naeslund, Histochemistry 98 (6) (1992) 341.
- (1992) Histochemistry , vol.98 , Issue.6 , pp. 341
- Thornell, L.E.¹ Holmbom, B.² Eriksson, A.³ Reiz, S.⁴ Marklund, S.⁵ Naeslund, U.⁶

30
- 0010691780
- New England Deaconess Hospital Comp., USA
- I.K. Ralph, W.F. Logerfo, New England Deaconess Hospital Comp., USA, 1994.
- (1994)
- Ralph, I.K.¹ Logerfo, W.F.²

31
- 0025494077
- M. Chikuma, M. Nishimura, React. Polym. 13 (1990) 131.
- (1990) React. Polym. , vol.13 , pp. 131
- Chikuma, M.¹ Nishimura, M.²

32
- 4043169229
- A.V. Bulatov, P.K.N. Raghavan, Izv. Akad. Nauk SSSR, Ser. Khim. (1991) 741-743.
- (1991) Izv. Akad. Nauk SSSR, Ser. Khim. , pp. 741-743
- Bulatov, A.V.¹ Raghavan, P.K.N.²

33
- 0030547629
- M.E. Khalifa, Chem. Anal. 41 (3) (1996) 357.
- (1996) Chem. Anal. , vol.41 , Issue.3 , pp. 357
- Khalifa, M.E.¹

34
- 0026080116
- A. Downard, H. Powell, J. Kipton, S. Xu, Anal. Chim. Acta 251 (1-2) (1991) 157.
- (1991) Anal. Chim. Acta , vol.251 , Issue.1-2 , pp. 157
- Downard, A.¹ Powell, H.² Kipton, J.³ Xu, S.⁴

35
- 0010692467
- J. Wang, Y. Wang, Zhonghua Yixue Jianyan Zazhi 11 (4) (1988) 204.
- (1988) Zhonghua Yixue Jianyan Zazhi , vol.11 , Issue.4 , pp. 204
- Wang, J.¹ Wang, Y.²

36
- 0010649399
- H. Ma, P. Yu, J. Feng, Huanjing Huaxue 7 (4) (1988) 39.
- (1988) Huanjing Huaxue , vol.7 , Issue.4 , pp. 39
- Ma, H.¹ Yu, P.² Feng, J.³

37
- 21344496690
- E. Soliman, A. Hassaan, Synth. React. Inorg. Met.-Org. Chem. 24 (2) (1994) 255.
- (1994) Synth. React. Inorg. Met.-Org. Chem. , vol.24 , Issue.2 , pp. 255
- Soliman, E.¹ Hassaan, A.²

38
- 0000702523
- T.J. Cardwell, R.W. Cattrall, M. Mitri, I.C. Hamilton, Anal. Chim. Acta 214 (1988) 433.
- (1988) Anal. Chim. Acta , vol.214 , pp. 433
- Cardwell, T.J.¹ Cattrall, R.W.² Mitri, M.³ Hamilton, I.C.⁴

39
- 36549092018
- M. Dolg, U. Wedig, H. Stoll, H. Preuss, J. Chem. Phys. 86 (1987) 866.
- (1987) J. Chem. Phys. , vol.86 , pp. 866
- Dolg, M.¹ Wedig, U.² Stoll, H.³ Preuss, H.⁴

40
- 11744322674
- D. Andrae, U. Haeusserman, M. Dolg, H. Preuss, Theor. Chim. Acta 77 (1990) 123.
- (1990) Theor. Chim. Acta , vol.77 , pp. 123
- Andrae, D.¹ Haeusserman, U.² Dolg, M.³ Preuss, H.⁴

41
- 0000856887
- M. Dolg, H. Stoll, A. Preuss, Theor. Chim. Acta 85 (1993) 441.
- (1993) Theor. Chim. Acta , vol.85 , pp. 441
- Dolg, M.¹ Stoll, H.² Preuss, A.³

42
- 0000073650
- M. Dolg, H. Stoll, A. Saun, H. Preuss, Theor. Chim. Acta 75 (1989) 173.
- (1989) Theor. Chim. Acta , vol.75 , pp. 173
- Dolg, M.¹ Stoll, H.² Saun, A.³ Preuss, H.⁴

43
- 0002670283
- T. Moeller, D.E. Martin, L.C. Thompson, R. Ferrus, G. Feistel, W.I. Randall, Chem. Rev. 65 (1965) 1.
- (1965) Chem. Rev. , vol.65 , pp. 1
- Moeller, T.¹ Martin, D.E.² Thompson, L.C.³ Ferrus, R.⁴ Feistel, G.⁵ Randall, W.I.⁶

44
- 0010649297
- H.S. Rana, J.P. Tandon, J. Gen. Chem. 48 (1978) 1762.
- (1978) J. Gen. Chem. , vol.48 , pp. 1762
- Rana, H.S.¹ Tandon, J.P.²

45
- 0010692578
- Données fondamentales pour la chimie O. Kahn, M.F. Koenig, Herman, 1972
- Données fondamentales pour la chimie O. Kahn, M.F. Koenig, Herman, 1972.

46
- 0010649819
- SocieteMARBARS.A., B.P.2929, Ain-Sebaa plage, Casablanca, Morocco
- R. Zakarya, SocieteMARBARS.A., B.P.2929, Ain-Sebaa plage, Casablanca, Morocco, 1996.
- (1996)
- Zakarya, R.¹

47
- 0010693532
- F. Jianyum, J. Tianzhu, X. Guangxiang, X. Jun, J. Cheneese, Rare-earth Soc. Desc. 5 (1987) 47.
- (1987) Rare-earth Soc. Desc. , vol.5 , pp. 47
- Jianyum, F.¹ Tianzhu, J.² Guangxiang, X.³ Jun, X.⁴ Cheneese, J.⁵

48
- 0010733913
- H. Beidi, G. Gan, J. Less-Common Met. 126 (1984) 357.
- (1984) J. Less-Common Met. , vol.126 , pp. 357
- Beidi, H.¹ Gan, G.²

49
- 0035877374
- M.L. Ferreiro, J. Rodriguez-Otero, J. Mol. Struct. (Theochem) 542 (2001) 63.
- (2001) J. Mol. Struct. (Theochem) , vol.542 , pp. 63
- Ferreiro, M.L.¹ Rodriguez-Otero, J.²

50
- 0001303474
- B. Roos, P. Siegbahn, Theor. Chim. Acta 17 (1970) 209.
- (1970) Theor. Chim. Acta , vol.17 , pp. 209
- Roos, B.¹ Siegbahn, P.²

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.