Crystallography Open Database

Information card for entry 7062950

Preview

Coordinates	7062950.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H55 Cl Cu2 N8 O16
Calculated formula	C49 H55 Cl Cu2 N8 O16
Title of publication	Influence of bridging atoms in copper-based coordination polymers for enhancing urease inhibition activity
Authors of publication	Wang, Ling-Li; Wang, Kai-Tong; Duan, Wen-Long; Luan, Jian; Han, Xiao-Ri
Journal of publication	New Journal of Chemistry
Year of publication	2024
Journal volume	48
Journal issue	6
Pages of publication	2787 - 2795
a	14.4011 ± 0.0008 Å
b	16.9452 ± 0.0008 Å
c	22.2478 ± 0.0012 Å
α	90°
β	101.857 ± 0.002°
γ	90°
Cell volume	5313.3 ± 0.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 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	0.0737
Residual factor for significantly intense reflections	0.0437
Weighted residual factors for significantly intense reflections	0.1119
Weighted residual factors for all reflections included in the refinement	0.1256
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
290240 (current)	2024-03-04	cif/ Updating files of 7062950, 7062951 Original log message: Adding full bibliography for 7062950--7062951.cif.	7062950.cif
288712	2024-01-06	cif/ Adding structures of 7062950, 7062951 via cif-deposit CGI script.	7062950.cif