Crystallography Open Database

Information card for entry 7245924

Preview

Coordinates	7245924.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H16 Cd N7 O5
Calculated formula	C23 H16 Cd N7 O5
Title of publication	Acid-directed synthesis of three Cd-based metal–organic frameworks with luminescence and catalytic CO2 transformation properties
Authors of publication	Zhang, Zhen-Wei; Hu, Hui; Wang, Ming-Zhen; Zhang, Qing; Zhou, Wen-Feng; Zhang, Yan-Kai; Yang, Xin-Yi; Liu, Xue-Ying; Zhang, Yong-Zheng; Geng, Longlong; Liu, Zhong-Min; Zhang, Da-Shuai; Zhuang, Shujuan; Wei, Rong-Min; Zhang, Xiuling
Journal of publication	CrystEngComm
Year of publication	2022
a	12.7245 ± 0.0014 Å
b	13.5981 ± 0.0019 Å
c	19.076 ± 0.003 Å
α	90°
β	104.107 ± 0.004°
γ	90°
Cell volume	3201.2 ± 0.8 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	I 1 2/m 1
Hall space group symbol	-I 2y
Residual factor for all reflections	0.0976
Residual factor for significantly intense reflections	0.0759
Weighted residual factors for significantly intense reflections	0.1927
Weighted residual factors for all reflections included in the refinement	0.2115
Goodness-of-fit parameter for all reflections included in the refinement	1.005
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
279631 (current)	2022-11-30	cif/ Adding structures of 7245924, 7245925, 7245926 via cif-deposit CGI script.	7245924.cif