Crystallography Open Database

Information card for entry 7249737

Preview

Coordinates	7249737.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C43 H22 Cd2 F4 N6 O8
Calculated formula	C43 H20 Cd2 F4 N6 O8
Title of publication	A versatile luminescent metal–organic framework for selective detection of Fe(iii) cations and Cr(vi) anions
Authors of publication	Fang, Han; Han, Jia-Peng; Zhang, Bo; Liu, Deng-Bo; Li, Xing-Wang; Li, Jing-Yu; He, Yutong; Yu, Mei-Hui
Journal of publication	CrystEngComm
Year of publication	2025
Journal volume	27
Journal issue	8
Pages of publication	1139 - 1145
a	28.2765 ± 0.0006 Å
b	17.2824 ± 0.0003 Å
c	27.3501 ± 0.0004 Å
α	90°
β	99.8503 ± 0.0018°
γ	90°
Cell volume	13168.6 ± 0.4 Å³
Cell temperature	151 ± 12 K
Ambient diffraction temperature	151 ± 12 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0455
Residual factor for significantly intense reflections	0.0427
Weighted residual factors for significantly intense reflections	0.1307
Weighted residual factors for all reflections included in the refinement	0.1326
Goodness-of-fit parameter for all reflections included in the refinement	1.076
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
298178 (current)	2025-03-04	cif/ Updating files of 7249737 Original log message: Adding full bibliography for 7249737.cif.	7249737.cif
297054	2025-01-04	cif/ Adding structures of 7249737 via cif-deposit CGI script.	7249737.cif