Crystallography Open Database

Information card for entry 2311468

Preview

Coordinates	2311468.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	(4,4'-Bipyridyl-κ<i>N</i>)bis(<i>N</i>-2-hydroxyethyl-<i>N</i>-isopropyldithiocarbamato-κ^2^<i>S</i>,<i>S</i>')cadmium(II)‒4,4'-bipyridyl (2/1)
Formula	C27 H36 Cd N5 O2 S4
Calculated formula	C27 H36 Cd N5 O2 S4
Title of publication	Crystal structure of (4,4'-bipyridyl-κ<i>N</i>)bis-[<i>N</i>-(2-hydroxy-ethyl)-<i>N</i>-iso-propyl-dithio-carbamato-κ<sup>2</sup><i>S</i>,<i>S</i>']zinc(II)-4,4'-bipyridyl (2/1) and its isostructural cadmium(II) analogue.
Authors of publication	Tan, Yee Seng; Tiekink, Edward R. T.
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2017
Journal volume	73
Journal issue	Pt 11
Pages of publication	1642 - 1646
a	22.7028 ± 0.0012 Å
b	11.595 ± 0.0006 Å
c	24.8196 ± 0.0013 Å
α	90°
β	103.385 ± 0.001°
γ	90°
Cell volume	6356 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
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	0.0217
Residual factor for significantly intense reflections	0.0186
Weighted residual factors for significantly intense reflections	0.0474
Weighted residual factors for all reflections included in the refinement	0.0492
Goodness-of-fit parameter for all reflections included in the refinement	0.993
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
245905 (current)	2019-12-25	cif/ Adding structures of 2311467, 2311468 via cif-deposit CGI script.	2311468.cif