Crystallography Open Database

Information card for entry 4338140

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Coordinates	4338140.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H21 N O14 Ru5 Se
Calculated formula	C22 H21 N O14 Ru5 Se
Title of publication	CO and CO2 Fixation by Se-Ru-CO Hydride Clusters.
Authors of publication	Shieh, Minghuey; Chu, Yen-Yi; Jang, Li-Fing; Ho, Chia-Hua
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	9
Pages of publication	4284 - 4286
a	11.4391 ± 0.0006 Å
b	24.1395 ± 0.0011 Å
c	33.9535 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	9375.7 ± 0.8 Å³
Cell temperature	200 ± 2 K
Ambient diffraction temperature	200 ± 2 K
Number of distinct elements	6
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0531
Residual factor for significantly intense reflections	0.0449
Weighted residual factors for significantly intense reflections	0.1125
Weighted residual factors for all reflections included in the refinement	0.1185
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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