Crystallography Open Database

Information card for entry 4065035

Preview

Coordinates	4065035.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H72 B2 Co F8 N8 O
Calculated formula	C40 H72 B2 Co F8 N8 O
Title of publication	Square-Planar Cobalt Complexes with Monodentate N-Heterocyclic Carbene Ligation: Synthesis, Structure, and Catalytic Application
Authors of publication	Mo, Zhenbo; Li, Yuxue; Lee, Hung Kay; Deng, Liang
Journal of publication	Organometallics
Year of publication	2011
Journal volume	30
Journal issue	17
Pages of publication	4687
a	11.4224 ± 0.0004 Å
b	11.4224 ± 0.0004 Å
c	32.1421 ± 0.0016 Å
α	90°
β	90°
γ	120°
Cell volume	3631.8 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	145
Hermann-Mauguin space group symbol	P 32
Hall space group symbol	P 32
Residual factor for all reflections	0.1413
Residual factor for significantly intense reflections	0.0573
Weighted residual factors for significantly intense reflections	0.0985
Weighted residual factors for all reflections included in the refinement	0.1173
Goodness-of-fit parameter for all reflections included in the refinement	0.792
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
178503 (current)	2016-03-21	cif/4/06/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/06/50.	4065035.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4065035.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4065035.cif
33139	2012-02-11	../uploads/cif-deposit/cod/cif Adding structures of 4065034, 4065035, 4065036, 4065037 via cif-deposit CGI script.	4065035.cif