Crystallography Open Database

Information card for entry 1571703

Preview

Coordinates	1571703.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	A2SnCl6
Chemical name	A2SnCl6
Formula	C16 H20 Cl6 N2 O2 Sn
Calculated formula	C16 H20 Cl6 N2 O2 Sn
Title of publication	High-efficiency color-tunable ultralong room-temperature phosphorescence from organic–inorganic metal halides via synergistic inter/intramolecular interactions
Authors of publication	Zhou, Lei; Li, Kailei; Chang, Yuanyuan; Yao, Yuan; Peng, Yuqi; Li, Ming; He, Rongxing
Journal of publication	Chemical Science
Year of publication	2024
Journal volume	15
Journal issue	26
Pages of publication	10046 - 10055
a	9.3919 ± 0.0006 Å
b	11.4149 ± 0.0007 Å
c	11.0818 ± 0.0006 Å
α	90°
β	108.353 ± 0.002°
γ	90°
Cell volume	1127.62 ± 0.12 Å³
Cell temperature	296.15 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0328
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0678
Weighted residual factors for all reflections included in the refinement	0.07
Goodness-of-fit parameter for all reflections included in the refinement	1.254
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
292873 (current)	2024-07-05	cif/ Updating files of 1571699, 1571700, 1571701, 1571702, 1571703, 1571704 Original log message: Adding full bibliography for 1571699--1571704.cif.	1571703.cif
292006	2024-05-24	cif/ Adding structures of 1571699, 1571700, 1571701, 1571702, 1571703, 1571704 via cif-deposit CGI script.	1571703.cif