Trichlorido(tetrahydrofuran){(1,2,3,3a,7a-η)-1-[2-(1-trimethylsilyl-1H-imidazol-2-yl-κN3)-1-methylpropyl]indenyl}zirconium(IV)

被引:2
作者
Guan, Shengzhou [1 ]
Nie, Wanli [1 ]
Borzov, Maxim V. [1 ]
机构
[1] NW Univ Xian, Key Lab Synthet & Nat Chem, Minist Educ, Coll Chem & Mat Sci, Xian 710069, Shaanxi Prov, Peoples R China
来源
ACTA CRYSTALLOGRAPHICA SECTION E-STRUCTURE REPORTS ONLINE | 2011年 / 67卷
基金
中国国家自然科学基金;
关键词
CRYSTAL-STRUCTURES; COMPLEXES; ZIRCONIUM; TITANIUM; BRIDGE; LIGAND;
D O I
10.1107/S1600536811012037
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The title compound, [ZrCl3(C19H25N2Si)(C4H8O)], was prepared from bis(N,N-dimethylamido-kappa N)(2-{2-[(1,2,3,3a,7a-eta)-indenyl]-2-methylpropyl}-1H-imidazolido-kappa N-1) zirconium(IV) [(C16H16N2)Zr(NMe2)] by reaction with excess Me3SiCl in tetrahydrofuran (THF) at elevated temperature. The crystal studied contained a minor non-merohedral twin contaminant [6.3 (4)%] which was taken into account during the refinement. The coordination polyhedron of the Zr-IV atom is a distorted octahedron [assuming that the five-membered ring of the indenyl group (Cp) occupies one coordination site], with the Cp group and a THF O atom at the apical positions and the three Cl and ligating N atoms at the equatorial positions. The Zr, Si and the methylene C atoms deviate noticeably from the imidazole ring plane [by -0.197 (5), -0.207 (5) and 0.119 (6) angstrom, respectively]. The THF ligand adopts an envelope conformation.
引用
收藏
页码:M540 / U379
页数:16
相关论文
共 19 条
[1]   The Cambridge Structural Database: a quarter of a million crystal structures and rising [J].
Allen, FH .
ACTA CRYSTALLOGRAPHICA SECTION B-STRUCTURAL SCIENCE, 2002, 58 (3 PART 1) :380-388
[2]  
Armarego W. L. F., 1997, Purification of Laboratory Chemicals, V4th
[3]   Constrained geometry complexes - Synthesis and applications [J].
Braunschweig, Holger ;
Breitling, Frank M. .
COORDINATION CHEMISTRY REVIEWS, 2006, 250 (21-22) :2691-2720
[4]  
Bruker, 2007, APEX2 SAINT
[5]   TETRAKISDIMETHYLAMIDOZIRCONIUM AND ITS DIMETHYLAMIDO LITHIUM ADDUCT - STRUCTURES OF [ZR(NME2)4]2 AND ZR(NME2)6LI2(THF)2 [J].
CHISHOLM, MH ;
HAMMOND, CE ;
HUFFMAN, JC .
POLYHEDRON, 1988, 7 (24) :2515-2520
[6]   AN EASILY INTRODUCED AND REMOVED PROTECTING GROUP FOR IMIDAZOLE NITROGEN - A CONVENIENT ROUTE TO 2-SUBSTITUTED IMIDAZOLES [J].
CURTIS, NJ ;
BROWN, RS .
JOURNAL OF ORGANIC CHEMISTRY, 1980, 45 (20) :4038-4040
[7]   Efficient synthesis of chiral ansa-metallocenes by amine elimination. Synthesis, structure, and reactivity of rac-(EBI)Zr(NMe(2))(2) [J].
Diamond, GM ;
Jordan, RF ;
Petersen, JL .
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 1996, 118 (34) :8024-8033
[8]   OLEX2: a complete structure solution, refinement and analysis program [J].
Dolomanov, Oleg V. ;
Bourhis, Luc J. ;
Gildea, Richard J. ;
Howard, Judith A. K. ;
Puschmann, Horst .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 2009, 42 :339-341
[9]   8-quinolylcyclopentadienyl, a ligand with a tailored fit for chelate complexes [J].
Enders, M ;
Rudolph, R ;
Pritzkow, H .
CHEMISCHE BERICHTE, 1996, 129 (04) :459-463
[10]   Syntheses and reactions of fulvene-derived substituted aminoalkyl-Cp and phosphinoalkyl-Cp-Group 4 metal complexes [J].
Erker, Gerhard .
COORDINATION CHEMISTRY REVIEWS, 2006, 250 (9-10) :1056-1070