Crystallography Open Database

Information card for entry 4336935

Preview

Coordinates	4336935.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H35.67 B3 Co2 F12 N10 O3.34
Calculated formula	C32 H35 B3 Co2 F12 N10 O3.33
Title of publication	"Criss-Crossed" Dinucleating Behavior of an N4 Schiff Base Ligand: Formation of a μ-OH,μ-O2 Dicobalt(III) Core via O2 Activation
Authors of publication	Yae In Cho; David M. Joseph; Michael J. Rose
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	13298 - 13300
a	10.372 ± 0.002 Å
b	13.56 ± 0.002 Å
c	16.459 ± 0.003 Å
α	75.856 ± 0.003°
β	73.453 ± 0.004°
γ	68.595 ± 0.003°
Cell volume	2040.2 ± 0.6 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 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	0.0743
Residual factor for significantly intense reflections	0.0634
Weighted residual factors for significantly intense reflections	0.1672
Weighted residual factors for all reflections included in the refinement	0.1761
Goodness-of-fit parameter for all reflections included in the refinement	1.163
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
179472 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/69.	4336935.cif
102989	2014-02-24	cif/ Adding structures of 4336935 via cif-deposit CGI script.	4336935.cif