Crystallography Open Database

Information card for entry 7247796

Preview

Coordinates	7247796.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54 H36 Co4 N4 O25
Calculated formula	C54 H36 Co4 N4 O25
Title of publication	Effects of solvents and metal ions on the synthesis, structural diversity and magnetic properties of the 5′-nitro-[1,1′:3′,1′′-terphenyl]-3,3′′,5,5′′-tetracarboxylic acid ligand and a highly sensitive sensor for Fe3+
Authors of publication	Yang, Yuan-Yu; Xue, Jian-Hua; Yang, Dong-Dong; Zhang, Li-Yang; Ma, Qi; Zhao, Xuan
Journal of publication	CrystEngComm
Year of publication	2024
Journal volume	26
Journal issue	2
Pages of publication	170 - 179
a	9.366 ± 0.0007 Å
b	10.5136 ± 0.0008 Å
c	15.0815 ± 0.0012 Å
α	107.389 ± 0.003°
β	91.634 ± 0.003°
γ	107.736 ± 0.003°
Cell volume	1338.12 ± 0.18 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1134
Residual factor for significantly intense reflections	0.0662
Weighted residual factors for significantly intense reflections	0.2087
Weighted residual factors for all reflections included in the refinement	0.2401
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
289447 (current)	2024-02-04	cif/ Updating files of 7247796, 7247797, 7247798, 7247799 Original log message: Adding full bibliography for 7247796--7247799.cif.	7247796.cif
287819	2023-11-28	cif/ Adding structures of 7247796, 7247797, 7247798, 7247799 via cif-deposit CGI script.	7247796.cif