Crystallography Open Database

Information card for entry 4329674

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Coordinates	4329674.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H28 Cl3 N5 O5 Ru
Calculated formula	C20 H28 Cl3 N5 O5 Ru
Title of publication	Structural Influence on the Photochromic Response of a Series of Ruthenium Mononitrosyl Complexes
Authors of publication	Benoit Cormary; Sonia Ladeira; Kane Jacob; Pascal G. Lacroix; Theo Woike; Dominik Schaniel; Isabelle Malfant
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	7492 - 7501
a	20.924 ± 0.005 Å
b	12.799 ± 0.006 Å
c	20.172 ± 0.007 Å
α	90°
β	150.243 ± 0.009°
γ	90°
Cell volume	2681.2 ± 1.8 Å³
Cell temperature	180 ± 2 K
Ambient diffraction temperature	180 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0278
Residual factor for significantly intense reflections	0.0251
Weighted residual factors for significantly intense reflections	0.0622
Weighted residual factors for all reflections included in the refinement	0.0641
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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