Crystallography Open Database

Information card for entry 7243615

Preview

Coordinates	7243615.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Zn-MOF
Formula	C16 H21 N2 O6 Zn
Calculated formula	C16 H21 N2 O6 Zn
Title of publication	Cation exchange in a fluorescent zinc-based metal–organic framework for cadmium ion detection
Authors of publication	Chen, Mao-Long; Qi, Zhen-Li; Jin, Wan-Ting; Xu, Zhou; Cheng, Yun-Hui; Zhou, Zhao-Hui
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	42
Pages of publication	7442 - 7449
a	18.3597 ± 0.0008 Å
b	30.8839 ± 0.0013 Å
c	11.3262 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	6422.2 ± 0.5 Å³
Cell temperature	193 K
Ambient diffraction temperature	193 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0772
Residual factor for significantly intense reflections	0.07
Weighted residual factors for significantly intense reflections	0.1844
Weighted residual factors for all reflections included in the refinement	0.1901
Goodness-of-fit parameter for all reflections included in the refinement	1.079
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
270418 (current)	2021-11-06	cif/ Updating files of 7243615 Original log message: Adding full bibliography for 7243615.cif.	7243615.cif
269326	2021-09-28	cif/ Adding structures of 7243615 via cif-deposit CGI script.	7243615.cif