Crystallography Open Database

Information card for entry 7005482

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Coordinates	7005482.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H12 Mn N6 O2 Ru
Calculated formula	C14 H10 Mn N6 O2 Ru
Title of publication	A CNT-like coordination tube with cyano-bridges
Authors of publication	Xia, Jun; Shi, Wei; Chen, Xiao-Yan; Wang, Hong-Sheng; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping
Journal of publication	Dalton Transactions
Year of publication	2007
Journal issue	23
Pages of publication	2373
a	29.884 ± 0.002 Å
b	29.884 ± 0.002 Å
c	9.7853 ± 0.0013 Å
α	90°
β	90°
γ	120°
Cell volume	7568 ± 1.2 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.046
Residual factor for significantly intense reflections	0.0302
Weighted residual factors for significantly intense reflections	0.0781
Weighted residual factors for all reflections included in the refinement	0.0879
Goodness-of-fit parameter for all reflections included in the refinement	0.991
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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