Crystallography Open Database

Information card for entry 7224072

Preview

Coordinates	7224072.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	{Co16 Cl4 [C40H44S4O4]4 [C13H7NO4]8}
Formula	C264 H232 Cl4 Co16 N8 O48 S16
Calculated formula	C264 H56 Cl4 Co16 N8 O48 S16
Title of publication	pH-dependent formation of different coordination cages based on Co4-TC4A secondary building units and bridging ligands
Authors of publication	Hang, Xinxin; Wang, Shentang; Zhu, Xiaofei; Han, Haitao; Liao, Wuping
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	26
Pages of publication	4938
a	30.163 ± 0.0003 Å
b	30.163 ± 0.0003 Å
c	21.6122 ± 0.0004 Å
α	90°
β	90°
γ	90°
Cell volume	19662.9 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	7
Space group number	87
Hermann-Mauguin space group symbol	I 4/m
Hall space group symbol	-I 4
Residual factor for all reflections	0.1157
Residual factor for significantly intense reflections	0.1102
Weighted residual factors for significantly intense reflections	0.3034
Weighted residual factors for all reflections included in the refinement	0.311
Goodness-of-fit parameter for all reflections included in the refinement	1.111
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
185188 (current)	2016-08-07	cif/ Updating files of 7224069, 7224070, 7224071, 7224072 Original log message: Adding full bibliography for 7224069--7224072.cif.	7224072.cif
175390	2016-02-02	cif/ Adding structures of 7224069, 7224070, 7224071, 7224072 via cif-deposit CGI script.	7224072.cif