Crystallography Open Database

Information card for entry 1574921

Preview

Coordinates	1574921.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H50 Cl10 In2 N4 O
Calculated formula	C52 H50 Cl10 In2 N4 O
Title of publication	Photosalient effect and reversible photochromic photoluminescence driven by cascade [2+2] cycloaddition reaction and water adsorption in 0D hybrid metal halide
Authors of publication	Chen, Chudong; Li, Ziquan; Xiao, Yonghong; Ye, Chenghao; Wei, Jianwu; Zeng, Ruosheng; Pang, Qi; Luo, Binbin
Journal of publication	Chemical Science
Year of publication	2025
a	10.8121 ± 0.0003 Å
b	15.0764 ± 0.0005 Å
c	18.006 ± 0.0004 Å
α	90.349 ± 0.002°
β	91.409 ± 0.002°
γ	95.489 ± 0.002°
Cell volume	2920.67 ± 0.14 Å³
Cell temperature	200 ± 0.1 K
Ambient diffraction temperature	200 ± 0.1 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.102
Residual factor for significantly intense reflections	0.0641
Weighted residual factors for significantly intense reflections	0.1612
Weighted residual factors for all reflections included in the refinement	0.1738
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
300163 (current)	2025-06-24	cif/ Adding structures of 1574919, 1574920, 1574921 via cif-deposit CGI script.	1574921.cif