Crystallography Open Database

Information card for entry 4074912

Preview

Coordinates	4074912.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H77 Cl2 N2 Si6 Ti
Calculated formula	C41 H77 Cl2 N2 Si6 Ti
Title of publication	Reduction of Tetravalent Group 4 Metal Complexes Supported by an Extremely Bulky, Unsymmetrically Substituted β-Diketiminato Ligand Leading to the Regioselective CN Bond Cleavage Giving Ring-Contracted Metal-Imido Complexes
Authors of publication	Hamaki, Hirofumi; Takeda, Nobuhiro; Tokitoh, Norihiro
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	10
Pages of publication	2457
a	47.617 ± 0.003 Å
b	9.5808 ± 0.0005 Å
c	23.4963 ± 0.0016 Å
α	90°
β	101.676 ± 0.003°
γ	90°
Cell volume	10497.4 ± 1.1 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0833
Residual factor for significantly intense reflections	0.0688
Weighted residual factors for significantly intense reflections	0.1583
Weighted residual factors for all reflections included in the refinement	0.1669
Goodness-of-fit parameter for all reflections included in the refinement	1.104
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178638 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/49.	4074912.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074912.cif
48953	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4074906, 4074907, 4074908, 4074909, 4074910, 4074911, 4074912 via cif-deposit CGI script.	4074912.cif