Crystallography Open Database

Information card for entry 4301633

Preview

Coordinates	4301633.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C53 H58 N Ni O1.5 P S
Calculated formula	C53 H58 N Ni O1.5 P S
Title of publication	Synthesis and Reactions of Mono- and Dinuclear Ni(I) Thiolate Complexes
Authors of publication	Mikinao Ito; Tsuyoshi Matsumoto; Kazuyuki Tatsumi
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	2215 - 2223
a	39.992 ± 0.01 Å
b	12.637 ± 0.003 Å
c	19.189 ± 0.005 Å
α	90°
β	100.963 ± 0.003°
γ	90°
Cell volume	9521 ± 4 Å³
Cell temperature	173.1 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for significantly intense reflections	0.0633
Weighted residual factors for all reflections included in the refinement	0.1818
Goodness-of-fit parameter for all reflections included in the refinement	1.183
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4301633.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4301633.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4301633.cif
1054	2010-03-28	cif/4/ Adding data extracted in Inorg-Chem-2009_01-10/ processing.	4301633.cif