Crystallography Open Database

Information card for entry 4302810

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Coordinates	4302810.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	ZnY6Si2S14
Chemical name	ZnY6Si2S14
Formula	S14 Si2 Y6 Zn
Calculated formula	S14 Si2 Y6 Zn
Title of publication	A Series of New Infrared NLO Semiconductors, ZnY6Si2S14, AlxDy3(SiyAl1-y)S7, and Al0.33Sm3SiS7
Authors of publication	Sheng-Ping Guo; Guo-Cong Guo; Ming-Sheng Wang; Jian-Ping Zou; Gang Xu; Guo-Jian Wang; Xi-Fa Long; Jin-Shun Huang
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	7059 - 7065
a	9.8071 ± 0.0013 Å
b	9.8071 ± 0.0013 Å
c	5.64 ± 0.0011 Å
α	90°
β	90°
γ	120°
Cell volume	469.78 ± 0.13 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	173
Hermann-Mauguin space group symbol	P 63
Hall space group symbol	P 6c
Residual factor for all reflections	0.0209
Residual factor for significantly intense reflections	0.0208
Weighted residual factors for significantly intense reflections	0.048
Weighted residual factors for all reflections included in the refinement	0.0481
Goodness-of-fit parameter for all reflections included in the refinement	1.002
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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