Crystallography Open Database

Information card for entry 7058149

Preview

Coordinates	7058149.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C57 H71 N18 O12 Zn5
Calculated formula	C57 H71 N18 O12 Zn5
Title of publication	Phosphatase-mimicking activity of a unique penta-nuclear zinc(ii) complex with a reduced Schiff base ligand: assessment of its ability to sense nitroaromatics
Authors of publication	Karmakar, Mainak; Basak, Tanmoy; Chattopadhyay, Shouvik
Journal of publication	New Journal of Chemistry
Year of publication	2019
Journal volume	43
Journal issue	11
Pages of publication	4432
a	27.683 ± 0.003 Å
b	18.147 ± 0.002 Å
c	13.1612 ± 0.0014 Å
α	90°
β	90.297 ± 0.004°
γ	90°
Cell volume	6611.6 ± 1.2 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1054
Residual factor for significantly intense reflections	0.0707
Weighted residual factors for significantly intense reflections	0.2009
Weighted residual factors for all reflections included in the refinement	0.22
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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
224979 (current)	2019-11-08	cif/ Updating files of 7058149 Original log message: Adding full bibliography for 7058149.cif.	7058149.cif
213511	2019-02-06	cif/ Adding structures of 7058149 via cif-deposit CGI script.	7058149.cif