Crystallography Open Database

Information card for entry 4306386

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Coordinates	4306386.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56.5 H69.5 Cl Cr N4 O
Calculated formula	C56.5 H69.5 Cl Cr N4 O
Title of publication	Metalloradical Complexes of Manganese and Chromium Featuring an Oxidatively Rearranged Ligand
Authors of publication	Remle Çelenligil-Çetin; Patrina Paraskevopoulou; Nikolia Lalioti; Yiannis Sanakis; Richard J. Staples; Nigam P. Rath; Pericles Stavropoulos
Journal of publication	Inorganic Chemistry
Year of publication	2008
Journal volume	47
Pages of publication	10998 - 11009
a	10.4052 ± 0.0006 Å
b	16.2284 ± 0.001 Å
c	16.2419 ± 0.001 Å
α	81.038 ± 0.001°
β	83.851 ± 0.001°
γ	75.692 ± 0.001°
Cell volume	2618.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1417
Residual factor for significantly intense reflections	0.0646
Weighted residual factors for significantly intense reflections	0.1486
Weighted residual factors for all reflections included in the refinement	0.1823
Goodness-of-fit parameter for all reflections included in the refinement	1.006
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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