Crystallography Open Database

Information card for entry 1550244

Preview

Coordinates	1550244.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H36 Cl4 Hg2 N8 O2 S6
Calculated formula	C22 H36 Cl4 Hg2 N8 O2 S6
Title of publication	Cytoprotective effects of imidazole-based [S<sub>1</sub>] and [S<sub>2</sub>]-donor ligands against mercury toxicity: a bioinorganic approach.
Authors of publication	Karri, Ramesh; Chalana, Ashish; Das, Ranajit; Rai, Rakesh Kumar; Roy, Gouriprasanna
Journal of publication	Metallomics : integrated biometal science
Year of publication	2019
Journal volume	11
Journal issue	1
Pages of publication	213 - 225
a	17.9245 ± 0.0016 Å
b	12.3888 ± 0.0016 Å
c	10.6773 ± 0.001 Å
α	90°
β	126.485 ± 0.005°
γ	90°
Cell volume	1906.3 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	7
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.029
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.0722
Weighted residual factors for all reflections included in the refinement	0.0729
Goodness-of-fit parameter for all reflections included in the refinement	1.336
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
224651 (current)	2019-11-08	cif/ Updating files of 1550243, 1550244, 1550245, 1550246, 1550247, 1550248, 1550249 Original log message: Adding full bibliography for 1550243--1550249.cif.	1550244.cif
211991	2018-11-16	cif/ Adding structures of 1550244 via cif-deposit CGI script.	1550244.cif