Crystallography Open Database

Information card for entry 1571542

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Coordinates	1571542.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C129 H104 B2 Cl N P4 Ru
Calculated formula	C129 H104 B2 Cl N P4 Ru
Title of publication	Isomerization reactions of metal vinylidene units.
Authors of publication	Zheng, Xuejuan; Huang, Fanping; Li, Xinyuan; Zhuo, Kaiyue; Chen, Dafa; Luo, Ming; Xia, Haiping
Journal of publication	Chemical science
Year of publication	2024
Journal volume	15
Journal issue	22
Pages of publication	8443 - 8450
a	17.3296 ± 0.0004 Å
b	17.6406 ± 0.0004 Å
c	18.5079 ± 0.0004 Å
α	79.837 ± 0.001°
β	73.958 ± 0.001°
γ	87.976 ± 0.001°
Cell volume	5351.8 ± 0.2 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0423
Residual factor for significantly intense reflections	0.0392
Weighted residual factors for significantly intense reflections	0.0971
Weighted residual factors for all reflections included in the refinement	0.099
Goodness-of-fit parameter for all reflections included in the refinement	1.032
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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