Crystallography Open Database

Information card for entry 7707521

Preview

Coordinates	7707521.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C288 H224 Co16 O100 S16
Calculated formula	C288 H224 Co16 O100 S16
Title of publication	Coordination-driven self-assembly of anthraquinone-based metal-organic cages for photocatalytic selective [2 + 2] cycloaddition.
Authors of publication	Jin, Yao; Jiang, Hong; Tang, Xianhui; Zhang, Wenqiang; Liu, Yan; Cui, Yong
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	50
Journal issue	24
Pages of publication	8533 - 8539
a	31.0736 ± 0.0006 Å
b	31.0736 ± 0.0006 Å
c	25.0692 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	24206 ± 1.2 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	5
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.1283
Residual factor for significantly intense reflections	0.0924
Weighted residual factors for significantly intense reflections	0.2524
Weighted residual factors for all reflections included in the refinement	0.2853
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
267135 (current)	2021-07-05	cif/ Updating files of 7707521, 7707522 Original log message: Adding full bibliography for 7707521--7707522.cif.	7707521.cif
265571	2021-05-28	cif/ Adding structures of 7707521, 7707522 via cif-deposit CGI script.	7707521.cif