Crystallography Open Database

Information card for entry 4103637

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Coordinates	4103637.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H53 Cr N2 O
Calculated formula	C38 H53 Cr N2 O
Title of publication	Exploring Chromium(III)-Alkyl Bond Homolysis with CpCr[(ArNCMe)2CH](R) Complexes
Authors of publication	K. Cory MacLeod; Julia L. Conway; Brian O. Patrick; Kevin M. Smith
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	17325 - 17334
a	16.8366 ± 0.0012 Å
b	20.2245 ± 0.0012 Å
c	9.8941 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	3369.1 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0897
Residual factor for significantly intense reflections	0.0605
Weighted residual factors for significantly intense reflections	0.162
Weighted residual factors for all reflections included in the refinement	0.1796
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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