Crystallography Open Database

Information card for entry 7153751

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Coordinates	7153751.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	MolGyro
Formula	C60 H112 Si2
Calculated formula	C60 H112 Si2
Title of publication	Ring-closing metathesis for the synthesis of a molecular gyrotop.
Authors of publication	Setaka, Wataru; Higa, Sayaka; Yamaguchi, Kentaro
Journal of publication	Organic & biomolecular chemistry
Year of publication	2014
Journal volume	12
Journal issue	21
Pages of publication	3354 - 3357
a	12.308 ± 0.007 Å
b	13.358 ± 0.007 Å
c	18.357 ± 0.01 Å
α	76.993 ± 0.007°
β	87.634 ± 0.008°
γ	86.828 ± 0.007°
Cell volume	2935 ± 3 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.3208
Residual factor for significantly intense reflections	0.0927
Weighted residual factors for significantly intense reflections	0.1639
Weighted residual factors for all reflections included in the refinement	0.2323
Goodness-of-fit parameter for all reflections included in the refinement	0.802
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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