Crystallography Open Database

Information card for entry 4341498

Preview

Coordinates	4341498.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H28 B2 Co F4 N4 O6
Calculated formula	C16 H28 B2 Co F4 N4 O6
Title of publication	Dihydrogen activation by cobaloximes with various axial ligands.
Authors of publication	Li, Gang; Estes, Deven P.; Norton, Jack R.; Ruccolo, Serge; Sattler, Aaron; Sattler, Wesley
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	19
Pages of publication	10743 - 10747
a	9.179 ± 0.008 Å
b	9.762 ± 0.008 Å
c	15.465 ± 0.01 Å
α	90°
β	126.03 ± 0.03°
γ	90°
Cell volume	1120.7 ± 1.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1456
Residual factor for significantly intense reflections	0.0588
Weighted residual factors for significantly intense reflections	0.1653
Weighted residual factors for all reflections included in the refinement	0.214
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179517 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/14.	4341498.cif
126696	2014-11-10	cif/ Adding structures of 4341498 via cif-deposit CGI script.	4341498.cif