Crystallography Open Database

Information card for entry 4103307

Preview

Coordinates	4103307.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C41 H52 Cl Co N2 O2
Calculated formula	C41 H52 Cl Co N2 O2
Title of publication	Redox-Active Ligand-Mediated Oxidative Addition and Reductive Elimination at Square Planar Cobalt(III): Multielectron Reactions for Cross-Coupling
Authors of publication	Aubrey L. Smith; Kenneth I. Hardcastle; Jake D. Soper
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	14358 - 14360
a	9.2497 ± 0.0002 Å
b	12.6393 ± 0.0003 Å
c	16.3642 ± 0.0004 Å
α	90°
β	100.554 ± 0.001°
γ	90°
Cell volume	1880.77 ± 0.08 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	7
Hermann-Mauguin space group symbol	P 1 c 1
Hall space group symbol	P -2yc
Residual factor for all reflections	0.0538
Residual factor for significantly intense reflections	0.0471
Weighted residual factors for significantly intense reflections	0.1105
Weighted residual factors for all reflections included in the refinement	0.1154
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
178779 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/33.	4103307.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4103307.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4103307.cif
26288	2011-09-21	../uploads/cif-deposit/cod/cif Adding structures of 4103307 via cif-deposit CGI script.	4103307.cif