Crystallography Open Database

Information card for entry 8107336

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Coordinates	8107336.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As10 Ca11
Calculated formula	As10 Ca11
Title of publication	Crystal structure of undecacalcium decaarsenide, Ca11As10
Authors of publication	Hoffmann, Andrea V.; Hlukhyy, Viktor; Fässler, Thomas F.
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	1
Pages of publication	1 - 3
a	11.2532 ± 0.0001 Å
b	11.2532 ± 0.0001 Å
c	16.2351 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	2055.92 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	139
Hermann-Mauguin space group symbol	I 4/m m m
Hall space group symbol	-I 4 2
Residual factor for all reflections	0.0423
Residual factor for significantly intense reflections	0.0347
Weighted residual factors for significantly intense reflections	0.0909
Weighted residual factors for all reflections included in the refinement	0.0931
Goodness-of-fit parameter for all reflections included in the refinement	1.133
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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