Crystallography Open Database

Information card for entry 4349302

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Coordinates	4349302.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46.6 H40 Cl6.4 N2 O12 Ru2
Calculated formula	C46.6 H37.2 Cl6.4 N2 O12 Ru2
Title of publication	Regulation of NO Uptake in Flexible Ru Dimer Chain Compounds with Highly Electron Donating Dopants.
Authors of publication	Zhang, Jun; Kosaka, Wataru; Fukunaga, Hiroki; Kitagawa, Susumu; Takata, Masaki; Miyasaka, Hitoshi
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	22
Pages of publication	12085 - 12092
a	9.882 ± 0.015 Å
b	11.598 ± 0.017 Å
c	13.116 ± 0.017 Å
α	80.29 ± 0.06°
β	78.65 ± 0.06°
γ	84.4 ± 0.06°
Cell volume	1450 ± 4 Å³
Cell temperature	112 K
Ambient diffraction temperature	112 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	0.2235
Residual factor for significantly intense reflections	0.1682
Weighted residual factors for significantly intense reflections	0.3973
Weighted residual factors for all reflections included in the refinement	0.4563
Goodness-of-fit parameter for all reflections included in the refinement	1.34
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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