Crystallography Open Database

Information card for entry 7247587

Preview

Coordinates	7247587.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H48 N10 S6 Sb2 Zn2
Calculated formula	C16 H48 N10 S6 Sb2 Zn2
Title of publication	Syntheses, crystal structure, and photoelectric properties of two Zn-based chalcogenidoantimonates Zn-Sb-Q (Q = S, Se).
Authors of publication	Zhang, Lirong; Zhao, Huiling; Liu, Xin; Teri, Gele; Baiyin, Menghe
Journal of publication	Physical chemistry chemical physics : PCCP
Year of publication	2023
Journal volume	25
Journal issue	43
Pages of publication	29709 - 29717
a	25.9513 ± 0.0011 Å
b	25.9513 ± 0.0011 Å
c	9.8863 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	6658.1 ± 0.6 Å³
Cell temperature	273.15 K
Ambient diffraction temperature	273.15 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0577
Residual factor for significantly intense reflections	0.0472
Weighted residual factors for significantly intense reflections	0.1145
Weighted residual factors for all reflections included in the refinement	0.1207
Goodness-of-fit parameter for all reflections included in the refinement	1.09
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
288905 (current)	2024-01-06	cif/ Updating files of 7247586, 7247587 Original log message: Adding full bibliography for 7247586--7247587.cif.	7247587.cif
287133	2023-10-27	cif/ Adding structures of 7247586, 7247587 via cif-deposit CGI script.	7247587.cif