Crystallography Open Database

Information card for entry 4309895

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Coordinates	4309895.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23.5 H33 B10 Cl N Ni O P
Calculated formula	C23.5 H33 B10 Cl N Ni O P
Title of publication	Synthesis of Nickel-Monocarbollide Complexes by Oxidative Insertion
Authors of publication	Thomas D. McGrath; Andreas Franken; Jason A. Kautz; F. Gordon A. Stone
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	8135 - 8144
a	9.7282 ± 0.0015 Å
b	12.0324 ± 0.0016 Å
c	13.36 ± 0.003 Å
α	100.44 ± 0.009°
β	97.678 ± 0.018°
γ	107.274 ± 0.01°
Cell volume	1439 ± 0.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0734
Residual factor for significantly intense reflections	0.0424
Weighted residual factors for significantly intense reflections	0.0968
Weighted residual factors for all reflections included in the refinement	0.1062
Goodness-of-fit parameter for all reflections included in the refinement	0.947
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
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.	4309895.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4309895.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4309895.cif
31985	2012-01-04	cif/ Canging data item '_diffrn_standards_decay_% none' to '_diffrn_standards_decay_% 0'.	4309895.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4309895.cif