Crystallography Open Database

Information card for entry 1573868

Preview

Coordinates	1573868.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H10 Cl10 N
Calculated formula	C25 H10 Cl10 N
Title of publication	Stable luminescent diphenylamine biphenylmethyl radicals with α-type D<sub>0</sub> → D<sub>1</sub> transition and antiferromagnetic properties.
Authors of publication	Gao, Shengxiang; Wu, Chunxiao; Zhang, Ming; Li, Feng
Journal of publication	Chemical science
Year of publication	2025
Journal volume	16
Journal issue	11
Pages of publication	4668 - 4675
a	8.305 ± 0.0015 Å
b	8.8068 ± 0.0017 Å
c	19.111 ± 0.004 Å
α	97.232 ± 0.007°
β	96.934 ± 0.007°
γ	95.16 ± 0.007°
Cell volume	1368.7 ± 0.5 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0676
Residual factor for significantly intense reflections	0.0521
Weighted residual factors for significantly intense reflections	0.1316
Weighted residual factors for all reflections included in the refinement	0.1431
Goodness-of-fit parameter for all reflections included in the refinement	1.137
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
298808 (current)	2025-04-05	cif/ Updating files of 1573868, 1573869 Original log message: Adding full bibliography for 1573868--1573869.cif.	1573868.cif
297669	2025-02-11	cif/ Adding structures of 1573868, 1573869 via cif-deposit CGI script.	1573868.cif