Crystallography Open Database

Information card for entry 4345529

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Structure parameters

Formula	C6 N6 O6 Sr3
Calculated formula	C6 N6 O6 Sr3
Title of publication	Formation, Structure, and Frequency-Doubling Effect of a Modification of Strontium Cyanurate (α-SCY).
Authors of publication	Kalmutzki, Markus Johannes; Dolabdjian, Konstantin; Wichtner, Nadja; Ströbele, Markus; Berthold, Christoph; Meyer, Hans-Jürgen
Journal of publication	Inorganic chemistry
Year of publication	2017
Journal volume	56
Journal issue	6
Pages of publication	3357 - 3362
a	10.7168 ± 0.0005 Å
b	11.7427 ± 0.0005 Å
c	8.212 ± 0.0004 Å
α	90°
β	97.079 ± 0.004°
γ	90°
Cell volume	1025.55 ± 0.08 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.039
Residual factor for significantly intense reflections	0.0384
Weighted residual factors for significantly intense reflections	0.0937
Weighted residual factors for all reflections included in the refinement	0.0944
Goodness-of-fit parameter for all reflections included in the refinement	1.03
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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