Crystallography Open Database

Information card for entry 1562755

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Coordinates	1562755.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C67.5 I8 Sn2
Calculated formula	C67.512 I8 Sn2
Title of publication	Generalizing the Chiral Self-Assembly of Spheres and Tetrahedra to Non-Spherical and Polydisperse Molecules in (C70)x(C60)1‒x(SnI4)2
Authors of publication	Straus, Daniel B.; Cava, Robert J.
Journal of publication	Nano Letters
Year of publication	2021
a	17.0312 ± 0.0003 Å
b	17.0312 ± 0.0003 Å
c	17.0312 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	4940.1 ± 0.15 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	3
Space group number	212
Hermann-Mauguin space group symbol	P 43 3 2
Hall space group symbol	P 4acd 2ab 3
Residual factor for all reflections	0.0823
Residual factor for significantly intense reflections	0.058
Weighted residual factors for significantly intense reflections	0.1532
Weighted residual factors for all reflections included in the refinement	0.1761
Goodness-of-fit parameter for all reflections included in the refinement	1.034
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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