Crystallography Open Database

Information card for entry 8000420

Preview

Coordinates	8000420.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H32 Cl8 N4 Sn
Calculated formula	C12 H32 Cl8 N4 Sn
Title of publication	Lead-Free Tin(IV)-Based Organic-Inorganic Metal Halide Hybrids with Excellent Stability and Blue-Broadband Emission.
Authors of publication	Song, Gaomin; Li, Mingze; Yang, Yi; Liang, Fei; Huang, Qian; Liu, Xiaomeng; Gong, Pifu; Xia, Zhiguo; Lin, Zheshuai
Journal of publication	The journal of physical chemistry letters
Year of publication	2020
Pages of publication	1808 - 1813
a	24.8035 ± 0.0006 Å
b	7.9768 ± 0.0002 Å
c	14.8847 ± 0.0003 Å
α	90°
β	121.21 ± 0.002°
γ	90°
Cell volume	2518.76 ± 0.11 Å³
Cell temperature	298.5 K
Ambient diffraction temperature	298.5 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0229
Residual factor for significantly intense reflections	0.0206
Weighted residual factors for significantly intense reflections	0.0472
Weighted residual factors for all reflections included in the refinement	0.048
Goodness-of-fit parameter for all reflections included in the refinement	1.048
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
248715 (current)	2020-03-04	cif/ Updating files of 8000420 Original log message: Adding full bibliography for 8000420.cif.	8000420.cif
248351	2020-02-21	cif/ Adding structures of 8000420 via cif-deposit CGI script.	8000420.cif