Crystallography Open Database

Information card for entry 7246157

Preview

Coordinates	7246157.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H51 N24 O22 S2 Sr
Calculated formula	C52 H51 N24 O22 S2 Sr
Title of publication	4,4′-Biphenyldisulfonic acid induced coordination polymers of symmetrical tetramethyl cucurbit[6]uril with alkaline-earth metals for detection of antibiotics
Authors of publication	Chen, Kai; Zhu, Zhao-Qiang; Zhang, Ming-Hui; Yang, Xiang; Li, Jie; Chen, Chen; Redshaw, Carl
Journal of publication	CrystEngComm
Year of publication	2023
Journal volume	25
Journal issue	6
Pages of publication	961 - 970
a	20.282 ± 0.005 Å
b	15.713 ± 0.005 Å
c	24.849 ± 0.005 Å
α	90 ± 0.005°
β	101.101 ± 0.005°
γ	90 ± 0.005°
Cell volume	7771 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1645
Residual factor for significantly intense reflections	0.11
Weighted residual factors for significantly intense reflections	0.2208
Weighted residual factors for all reflections included in the refinement	0.2387
Goodness-of-fit parameter for all reflections included in the refinement	1.015
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
281449 (current)	2023-03-04	cif/ Updating files of 7246155, 7246156, 7246157 Original log message: Adding full bibliography for 7246155--7246157.cif.	7246157.cif
280422	2023-01-19	cif/ Adding structures of 7246155, 7246156, 7246157 via cif-deposit CGI script.	7246157.cif