Crystallography Open Database

Information card for entry 1577072

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Coordinates	1577072.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H46 B10 Sb2
Calculated formula	C40 H46 B10 Sb2
Title of publication	Bridging Lewis Acidic Antimony Centers with Electron-Withdrawing Carborane Cages
Authors of publication	Rubio, Victoria P.; Durham, Mckinley H.; Scurria, Matthew; Kerr, Tyler A.; Gutierrez, Osvaldo; Spokoyny, Alex
Journal of publication	Chemical Science
Year of publication	2026
a	28.04 ± 0.002 Å
b	9.8956 ± 0.0008 Å
c	19.6271 ± 0.0015 Å
α	90°
β	133.375 ± 0.0015°
γ	90°
Cell volume	3958.5 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.052
Residual factor for significantly intense reflections	0.0455
Weighted residual factors for significantly intense reflections	0.1042
Weighted residual factors for all reflections included in the refinement	0.1085
Goodness-of-fit parameter for all reflections included in the refinement	1.206
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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