Crystallography Open Database

Information card for entry 7062079

7062078 << 7062079 >> 7062080

Preview

Coordinates	7062079.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	CUST-752
Formula	C38 H36 Cd3 N10 O20 S2
Calculated formula	C38 H32 Cd3 N10 O20 S2
Title of publication	Two new transition metal–organic frameworks as multiresponsive fluorescence sensors for detecting Fe3+, Cr2O72− and TNP
Authors of publication	Li, Jun-Jun; Feng, Zhen-Jie; Wu, Xue-Song; Li, Ying; Wu, Di; Sun, Jing; Wang, Xin-Long; Su, Zhong-Min
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	47
Pages of publication	22739 - 22745
a	8.8442 ± 0.0016 Å
b	10.1875 ± 0.0016 Å
c	14.161 ± 0.003 Å
α	99.619 ± 0.009°
β	104.626 ± 0.01°
γ	108.469 ± 0.008°
Cell volume	1127.7 ± 0.4 Å³
Cell temperature	294.91 K
Ambient diffraction temperature	294.91 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0768
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.0773
Weighted residual factors for all reflections included in the refinement	0.0857
Goodness-of-fit parameter for all reflections included in the refinement	1.047
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
280197 (current)	2023-01-06	cif/ Updating files of 7062079, 7062080 Original log message: Adding full bibliography for 7062079--7062080.cif.	7062079.cif
279372	2022-11-18	cif/ Adding structures of 7062079, 7062080 via cif-deposit CGI script.	7062079.cif