Crystallography Open Database

Information card for entry 7122347

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Coordinates	7122347.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C19 H38 B9 N2 Na O6
Calculated formula	C19 H38 B9 N2 Na O6
Title of publication	Rhodium(iii)-catalyzed dehydrogenative dialkenylation of the monocarba-closo-decaborate cluster by regioselective B-H activation.
Authors of publication	Liang, Xuewei; Shen, Yunjun; Zhang, Kang; Liu, Jiyong; Duttwyler, Simon
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2018
Journal volume	54
Journal issue	88
Pages of publication	12451 - 12454
a	11.6821 ± 0.001 Å
b	16.6672 ± 0.0016 Å
c	16.3779 ± 0.0011 Å
α	90°
β	110.407 ± 0.009°
γ	90°
Cell volume	2988.8 ± 0.5 Å³
Cell temperature	149.9 K
Ambient diffraction temperature	149.9 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.1276
Residual factor for significantly intense reflections	0.0971
Weighted residual factors for significantly intense reflections	0.2546
Weighted residual factors for all reflections included in the refinement	0.282
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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