Crystallography Open Database

Information card for entry 7251189

Preview

Coordinates	7251189.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H15 Br4 Cd F N2
Calculated formula	C10 H15 Br4 Cd F N2
Title of publication	Zero-dimensional organic–inorganic hybrid cadmium halides with broadband blue light emission
Authors of publication	Li, Jia-Peng; Yuan, Li; Li, Ping; Wu, Ming; Xie, Yong-Tai; Lei, Xiao-Wu; Jing, Zhi-Hong; Gong, Zhongliang
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	45
Pages of publication	7348 - 7357
a	8.1636 ± 0.0003 Å
b	21.034 ± 0.0009 Å
c	9.962 ± 0.0004 Å
α	90°
β	102.756 ± 0.001°
γ	90°
Cell volume	1668.39 ± 0.12 Å³
Cell temperature	273.15 K
Ambient diffraction temperature	273.15 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	0.0509
Residual factor for significantly intense reflections	0.0329
Weighted residual factors for significantly intense reflections	0.0738
Weighted residual factors for all reflections included in the refinement	0.0821
Goodness-of-fit parameter for all reflections included in the refinement	0.955
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
303710 (current)	2025-11-29	cif/ Updating files of 7251188, 7251189 Original log message: Adding full bibliography for 7251188--7251189.cif.	7251189.cif
303123	2025-11-01	cif/ Adding structures of 7251188, 7251189 via cif-deposit CGI script.	7251189.cif