Crystallography Open Database

Information card for entry 7125028

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Coordinates	7125028.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H24 B10 O8
Calculated formula	C12 H24 B10 O8
Title of publication	Palladium catalyzed/silver tuned selective mono-/tetra-acetoxylation of o-carboranes via B-H activation.
Authors of publication	Cao, Ke; Xu, Tao-Tao; Wu, Ji; Jiang, Linhai; Yang, Junxiao
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2016
Journal volume	52
Journal issue	76
Pages of publication	11446 - 11449
a	11.7899 ± 0.0006 Å
b	13.5842 ± 0.0004 Å
c	13.728 ± 0.0007 Å
α	90°
β	104.058 ± 0.005°
γ	90°
Cell volume	2132.78 ± 0.17 Å³
Cell temperature	294.96 ± 0.1 K
Ambient diffraction temperature	294.96 ± 0.1 K
Number of distinct elements	4
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	0.1371
Residual factor for significantly intense reflections	0.0772
Weighted residual factors for significantly intense reflections	0.1995
Weighted residual factors for all reflections included in the refinement	0.2483
Goodness-of-fit parameter for all reflections included in the refinement	1.047
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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