Synthesis, crystal structure, IR and Raman properties of 1,2-diacetamidocyclohexane and its complexes with ZnBr2 and HBr3

被引：4

作者：

Bekaert, A

Lemoine, P ^{[1
]}

Viossat, B

Jouan, M

Gemeiner, P

Brion, JD

机构：

[1] Univ Paris 05, Fac Sci Pharmaceut & Biol, CNRS, UMR 8015,Lab Cristallog & RMN Biol, F-75006 Paris, France

[2] Univ Paris 11, Fac Pharm, Chim Therapeut Lab,UPRES A 8076, BioCIS,CNRS, F-92290 Chatenay Malabry, France

[3] Ecole Cent Paris, CNRS, UMR 8580, Lab SPMS, F-92290 Chatenay Malabry, France

来源：

JOURNAL OF MOLECULAR STRUCTURE | 2005年 / 738卷 / 1-3期

关键词：

DAACH; complexes with Zn(II) or H+; X-ray structures; IR; Raman;

D O I：

10.1016/j.molstruc.2004.10.068

中图分类号：

O64 [物理化学（理论化学）、化学物理学];

学科分类号：

070304 ; 081704 ;

摘要：

X-ray crystallography, infrared absorption and Raman scattering were applied to study the influence of Zn(II) or H+ on the amidic bond. (R,R)-1,2-diacetamidocyclohexane (DAACH) was chosen as a conformationally strained chiral building block including two amide bonds; this model is hoped to be not too far from a peptide and gives easily crystalline complexes. Crystallographic structures of DAACH molecule (1), DAACH/ZnBr2 (2) and DAACH/HBr3 (3) complexes were studied. Complexation of Zn by DAACH is due to the hyperpolarization of the amidic bond. IR and Raman studies of 1-3 agree with the X-ray results. This could be a model in the study of metal/proteins interactions or acidic denaturation of polypeptides. (c) 2004 Elsevier B.V. All rights reserved.

引用

页码：39 / 44

页数：6

共 18 条

[1] Spectral and XRD studies on perchlorate salts of several Co(II), Ni(II), Cu(II), Zn(II), Cd(II) and Hg(II) complexes from 1-methyllumazine and 1,6,7-trimethyllumazine [J].

Acuña-Cueva, ER ;

Faure, R ;

Illán-Cabeza, NA ;

Jiménez-Pulido, SB ;

Moreno-Carretero, MN .

POLYHEDRON, 2002, 21 (19) :1961-1968

[2]

ADAMS DM, 1967, METAL LIGAND RELATED, P79

[3] SIR92 - a program for automatic solution of crystal structures by direct methods [J].

ALTOMARE, A ;

CASCARANO, G ;

GIACOVAZZO, G ;

GUAGLIARDI, A ;

BURLA, MC ;

POLIDORI, G ;

CAMALLI, M .

JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1994, 27 :435-435

[4]

[Anonymous], 1994, CAD4 EXPR SOFTW

[5] catena-Poly[[dibromozinc(II)]-μ-(R,R)-1,2-diacetamidocyclohexane] [J].

Bekaert, A ;

Lemoine, P ;

Brion, JD ;

Viossat, B .

ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE, 2003, 59 :M574-M575

[6]

Bekaert A, 2003, Z KRIST-NEW CRYST ST, V218, P123

[7]

Bekaert A, 2002, Z KRIST-NEW CRYST ST, V217, P128

[8]

Farrugia L. J., 1999, J. Appl. Crystallogr, V32, P837, DOI DOI 10.1107/S0021889899006020

[9]

Ferraro J.R., 1971, Low-Frequency Vibrations of Inorganic and Coordination Compounds

[10] Thermal studies and vibrational analyses of m-methylaniline complexes of Zn(II), Cd(II) and Hg(II) bromides [J].

Golcuk, K ;

Altun, A ;

Kumru, M .

SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 2003, 59 (08) :1841-1847

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