Crystallography Open Database

Information card for entry 7002872

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Structure parameters

Formula	C148 H170 B4 N12 O3 Ru2
Calculated formula	C148 H170 B4 N12 O3 Ru2
Title of publication	Synthesis and characterization of neutral iron(ii) and ruthenium(ii) complexes with the isocyanotriphenylborate ligand
Authors of publication	Zhou, Yan; Xiao, Hong-Ping; Kang, Ling-Chen; Zuo, Jing-Lin; Li, Cheng-Hui; You, Xiao-Zeng
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	46
Pages of publication	10256 - 10262
a	15.973 ± 0.011 Å
b	19.944 ± 0.013 Å
c	26.817 ± 0.014 Å
α	90 ± 0.014°
β	122.53 ± 0.03°
γ	90 ± 0.013°
Cell volume	7203 ± 8 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0787
Residual factor for significantly intense reflections	0.0562
Weighted residual factors for significantly intense reflections	0.1311
Weighted residual factors for all reflections included in the refinement	0.14
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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