SCOPUS 정보 검색 플랫폼

Journal of Computer-Aided Molecular Design

Volumn 15, Issue 2, 2001, Pages 183-193

A theoretical approach to the influence of the macrocycle conformation on the molecular electronic structure in Mg-porphyrins

(4) Poveda, L A a Ferro, V R a Garcia De La Vega J M b Gonzalez Jonte R H b

a Centro de Investigaciones de Energía Solar (Cuba)

b UNIVERSIDAD AUTÓNOMA DE MADRID (Spain)

Author keywords

Distortion energies; Nonplanar distortion modes; Porphyrin macrocycle; Semiempirical calculations; UV visible spectra

Indexed keywords

CONFORMATIONS; DEFORMATION; ELECTRONIC PROPERTIES; ELECTRONIC STRUCTURE; GEOMETRY; SCAFFOLDS (BIOLOGY);

DEGREE OF DEFORMATIONS; DISTORTION ENERGY; MACROCYCLE CONFORMATIONS; MACROCYCLES; MOLECULAR ELECTRONIC STRUCTURE; NONPLANAR DISTORTION MODE; PORPHYRIN MACROCYCLE; SEMI-EMPIRICAL CALCULATION; THEORETICAL APPROACH; UV-VISIBLE SPECTRUM;

PORPHYRINS;

MACROCYCLIC COMPOUND; MAGNESIUM; PORPHYRIN; PROTEIN;

ARTICLE; CALCULATION; CHEMICAL STRUCTURE; COMPUTER; CONFORMATION; CONTROLLED STUDY; ELECTRONICS; GEOMETRY; PARAMETER; PRIORITY JOURNAL; SYNTHESIS; THEORY;

EID: 0035146718 PISSN: 0920654X EISSN: None Source Type: Journal
DOI: 10.1023/A:1008120131665 Document Type: Article

Times cited : (7)

References (29)

1
- 0032351444
- (1998) Chem. Soc. Rev. , vol.27 , pp. 31
- Shelnutt, J.A.¹ Song, X.Z.² Ma, J.G.³ Jia, S.L.⁴ Jentzen, W.⁵ Medforth, C.J.⁶

2
- 0028923142
- and references therein.
- (1995) J. Protein Chem. , vol.14 B , pp. 19
- Hobbs, J.D.¹ Shelnutt, J.A.²

3
- 33845278875
- (1988) J. Am. Chem. Soc. , vol.110 , pp. 7566
- Barkigia, K.M.¹ Chantranupong, L.² Smith, K.M.³ Fajer, J.J.⁴

4
- 0000551601
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 3627
- Barkigia, K.M.¹ Renner, M.W.² Furenlid, L.R.³ Medforth, C.J.⁴ Smith, K.M.⁵ Fajer, J.⁶

5
- 0001724140
- (1990) J. Am. Chem. Soc. , vol.0 , pp. 8851
- Barkigia, K.M.¹ Berber, M.D.² Fajer, J.³ Medforth, C.J.⁴ Renner, M.W.⁵ Smith, K.M.⁶

6
- 33751158357
- (1994) Inorg. Chem. , vol.33 , pp. 3865
- Medforth, C.J.¹ Senge, M.O.² Forsyth, T.P.³ Hobbs, D.J.⁴ Shelnutt, J.A.⁵ Smith, K.M.⁶

7
- 0001215626
- (1992) J. Am. Chem. Soc. , vol.114 , pp. 9859
- Medforth, C.J.¹ Senge, M.O.² Smith, K.M.³ Sparks, L.D.⁴ Shelnutt, J.A.⁵

8
- 0031078856
- (1997) J. Phys. Chem. , vol.101 B , pp. 1684
- Jentzen, W.¹ Song, X.Z.² Shelnutt, J.A.³

9
- 0029394753
- (1995) J. Am. Chem. Soc. , vol.117 , pp. 11085
- Jentzen, W.¹ Simpson, M.C.² Hobbs, J.D.³ Song, X.Z.⁴ Ema, T.⁵ Nelson, N.Y.⁶ Medforth, C.J.⁷ Smith, K.M.⁸ Veyrat, M.⁹ Mazzanti, M.¹⁰ Ramasseul, R.¹¹ Marchon, J.C.¹² Takeuchi, T.¹³ Goddar, W.A.¹⁴ Shelnutt, J.A.¹⁵

10
- 0025358916
- (1990) Tetrahedron Lett. , vol.31 , pp. 3719
- Medforth, C.J.¹ Berber, M.D.² Smith, K.M.³ Shelnutt, J.⁴

11
- 0001368841
- (1993) Inorg. Chem. , vol.32 , pp. 1716
- Senge, M.O.¹ Medforth, C.J.² Sparks, L.D.³ Shelnutt, J.A.⁴ Smith, K.M.⁵

12
- 0030479176
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 12975
- Song, X.Z.¹ Jentzen, W.² Jia, S.L.³ Jaquinod, L.⁴ Nurco, D.J.⁵ Medforth, C.J.⁶ Smith, K.M.⁷ Shelnutt, J.A.⁸

13
- 0000429409
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 8582
- Renner, M.W.¹ Barkigia, K.M.² Zhang, Y.³ Medforth, C.J.⁴ Smith, K.M.⁵ Fajer, J.⁶

14
- 0029798418
- (1996) J. Am. Chem. Soc. , vol.118 , pp. 10918
- Nurco, D.J.¹ Medforth, C.J.² Forsyth, T.P.³ Olmstead, M.M.⁴ Smith, K.M.⁵

15
- 0000562570
- (1993) J. Am. Chem. Soc. , vol.115 , pp. 581
- Sparks, L.D.¹ Medforth, C.J.² Park, M.S.³ Chamberlain, J.R.⁴ Ondrias, M.R.⁵ Senge, M.O.⁶ Smith, K.M.⁷ Shelnutt, J.A.⁸

16
- 0001514543
- (1991) J. Am. Chem. Soc. , vol.113 , pp. 4077
- Shelnutt, J.A.¹ Medforth, C.J.² Berber, M.D.³ Barkigia, K.M.⁴ Smith, K.M.⁵

17
- 4243795863
- (1994) Inorg. Chem. , vol.0 , pp. 2279
- Sparks, L.D.¹ Anderson, K.K.² Medforth, C.J.³ Smith, K.M.⁴ Shelnutt, J.A.⁵

18
- 0000423587
- (1993) J. Phys. Chem. , vol.97 , pp. 7441
- Piffat, Ch.¹ Melamed, D.² Spiro, Th.G.³

19
- 0001176736
- (1993) J. Phys. Chem. , vol.97 , pp. 3701
- Stichternath, A.¹ Schweitzer-Stenner, R.² Dreybridt, W.³ Mak, R.S.M.⁴ Li, X.Y.⁵ Sparks, L.D.⁶ Shelnutt, J.A.⁷ Medforth, C.J.⁸ Smith, K.M.⁹

20
- 84988154432
- (1992) J. Raman Spect. , vol.23 , pp. 523
- Shelnutt, J.A.¹ Majumder, S.A.² Sparks, L.D.³ Hobbs, D.J.⁴ Medforth, C.J.⁵ Senge, M.O.⁶ Smith, K.M.⁷ Miura, M.⁸ Luo, L.⁹ Quirke, J.M.E.¹⁰

21
- 0000567501
- (1995) Chem. Phys. Lett. , vol.245 , pp. 441
- Gentemann, S.¹ Medforth, C.J.² Ema, T.³ Nelson, N.Y.⁴ Smith, K.M.⁵ Fajer, J.⁶ Holten, D.⁷

22
- 0001176640
- (1996) J. Phys. Chem. , vol.100 , pp. 1184
- Drain, Ch.M.¹ Kirmaier, Ch.² Medforth, C.J.³ Nurco, D.J.⁴ Smith, K.M.⁵ Holten, D.⁶

23
- 0034665544
- (2000) Phys. Chem. Chem. Phys. , vol.2 , pp. 4147
- Poveda, L.A.¹ Ferro, V.R.² García de la Vega, J.M.³ González-Jonte, R.H.⁴

24
- 0028409290
- (1994) J. Am. Chem. Soc. , vol.116 , pp. 3261
- Hobbs, D.J.¹ Majunder, S.A.² Luo, L.³ Sickelsmith, G.A.⁴ Quirke, J.M.E.⁵ Medforth, C.J.⁶ Smith, K.M.⁷ Shelnutt, J.A.⁸

25
- 84988129057
- (1989) J. Comput. Chem. , vol.10 , pp. 209
- Stewart, J.J.P.¹

26
- 0006319961
- Q. C. P. E. no. 581
- (1990)
- Stewart, J.J.P.¹

27
- 84988122931
- (1986) J. Comput. Chem. , vol.7 , pp. 385
- Baker, J.¹

28
- 36849107750
- (1968) J. Chem. Phys. , vol.48 , pp. 1807
- del Bene, J.¹ Jaffé, H.H.²

29
- 0006329769
- NDOL-Programs Package. Version 3.0, La Habana
- (1995)
- Montero, L.A.¹

* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.