Crystallography Open Database

Information card for entry 7249428

Preview

Coordinates	7249428.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H34 Cd2 N6 O10 S2
Calculated formula	C42 H34 Cd2 N6 O10 S2
Title of publication	Effects of the recognition sites of MOFs on turn-off fluorescence detection of Fe3+
Authors of publication	Li, Senlin; Gu, Yanan; Zhao, Bo; Cai, Haocheng; Zhao, Zhuo; Sun, Qiaozhen; Zhang, Bingguang
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	43
Pages of publication	6126 - 6133
a	10.327 ± 0.001 Å
b	13.8387 ± 0.0013 Å
c	18.3399 ± 0.0018 Å
α	102.548 ± 0.001°
β	101.141 ± 0.001°
γ	102.354 ± 0.001°
Cell volume	2418.9 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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	0.0601
Residual factor for significantly intense reflections	0.036
Weighted residual factors for significantly intense reflections	0.08
Weighted residual factors for all reflections included in the refinement	0.0848
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
296455 (current)	2024-12-06	cif/ Updating files of 7249427, 7249428 Original log message: Adding full bibliography for 7249427--7249428.cif.	7249428.cif
295076	2024-10-06	cif/ Adding structures of 7249427, 7249428 via cif-deposit CGI script.	7249428.cif