Crystallography Open Database

Information card for entry 4074910

Preview

Coordinates	4074910.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H107 Cl2 Hf Li N4 Si6
Calculated formula	C53 H107 Cl2 Hf Li N4 Si6
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	12.6966 ± 0.0017 Å
b	15.754 ± 0.002 Å
c	19.249 ± 0.003 Å
α	72.09 ± 0.005°
β	69.348 ± 0.004°
γ	77.721 ± 0.006°
Cell volume	3404.7 ± 0.8 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0249
Residual factor for significantly intense reflections	0.0225
Weighted residual factors for significantly intense reflections	0.0487
Weighted residual factors for all reflections included in the refinement	0.0498
Goodness-of-fit parameter for all reflections included in the refinement	1.062
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.	4074910.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074910.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.	4074910.cif