Crystallography Open Database

Information card for entry 4128198

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Coordinates	4128198.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C60 H118 Ge2 Si8
Calculated formula	C60 H118 Ge2 Si8
Title of publication	Reversible Isomerizations between 1,4-Digermabenzenes and 1,4-Digerma-Dewar-benzenes: Air-Stable Activators for Small Molecules.
Authors of publication	Sugahara, Tomohiro; Guo, Jing-Dong; Hashizume, Daisuke; Sasamori, Takahiro; Tokitoh, Norihiro
Journal of publication	Journal of the American Chemical Society
Year of publication	2019
Journal volume	141
Journal issue	6
Pages of publication	2263 - 2267
a	9.1996 ± 0.0005 Å
b	22.4437 ± 0.0009 Å
c	17.8293 ± 0.001 Å
α	90°
β	101.764 ± 0.005°
γ	90°
Cell volume	3603.9 ± 0.3 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	4
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	0.0741
Residual factor for significantly intense reflections	0.0479
Weighted residual factors for significantly intense reflections	0.1169
Weighted residual factors for all reflections included in the refinement	0.1289
Goodness-of-fit parameter for all reflections included in the refinement	1.067
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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