Crystallography Open Database

Information card for entry 2311363

Preview

Coordinates	2311363.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Poly[[bis[μ~2~-<i>N</i>-ethyl-<i>N</i>-(pyridin-4-ylmethyl)dithiocarbamato-\ κ^3^<i>N</i>:<i>S</i>,<i>S</i>']cadmium(II)] 3-methylpyridine monosolvate]
Formula	C24 H29 Cd N5 S4
Calculated formula	C24 H29 Cd N5 S4
Title of publication	A two-dimensional coordination polymer: poly[[bis-[μ<sub>2</sub>-<i>N</i>-ethyl-<i>N</i>-(pyridin-4-ylmeth-yl)di-thio-carbamato-κ<sup>3</sup><i>N</i>:<i>S</i>,<i>S</i>']cadmium(II)] 3-methyl-pyridine monosolvate].
Authors of publication	Arman, Hadi D.; Poplaukhin, Pavel; Tiekink, Edward R. T.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2017
Journal volume	73
Journal issue	Pt 4
Pages of publication	488 - 492
a	9.5842 ± 0.0015 Å
b	11.0788 ± 0.0016 Å
c	12.989 ± 0.002 Å
α	90°
β	100.014 ± 0.004°
γ	90°
Cell volume	1358.2 ± 0.4 Å³
Cell temperature	98 ± 2 K
Ambient diffraction temperature	98 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0374
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.0905
Weighted residual factors for all reflections included in the refinement	0.0907
Goodness-of-fit parameter for all reflections included in the refinement	1.075
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
245827 (current)	2019-12-25	cif/ Adding structures of 2311363 via cif-deposit CGI script.	2311363.cif