Crystallography Open Database

Information card for entry 1557434

Preview

Coordinates	1557434.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Bromotetrakis(3,4-dimethylpyridine)cobalt(II) Bromide
Formula	C28 H36 Br2 Co N4
Calculated formula	C28 Br2 Co N4
SMILES	[Co]([n]1cc(c(cc1)C)C)([n]1cc(c(cc1)C)C)(Br)([n]1cc(c(cc1)C)C)[n]1cc(c(cc1)C)C.[Br-]
Title of publication	Pyridine-Type Complexes of Transition-Metal Halides. IX. Preparation and Characterization of 2,4- and 3,4-Dimethylpyridine Complexes of Cobalt(II) Bromide: the Crystal Structure of Dibromobis(2,4-dimethylpyridine)cobalt(II) and Bromotetrakis(3,4-dimethylpyridine)cobalt(II) Bromide
Authors of publication	Kansikas, Jarno; Leskela, Markku; Kenessey, Gabor; Wadsten, Tommy; Liptay, Gyorgy
Journal of publication	Acta Chemica Scandinavica
Year of publication	1996
Journal volume	50
Pages of publication	267 - 274
a	14.817 ± 0.003 Å
b	13.29 ± 0.003 Å
c	14.871 ± 0.003 Å
α	90°
β	90.55 ± 0.03°
γ	90°
Cell volume	2928.2 ± 1.1 Å³
Ambient diffraction temperature	293 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 significantly intense reflections	0.0602
Weighted residual factors for significantly intense reflections	0.0808
Goodness-of-fit parameter for all reflections included in the refinement	0.77
Diffraction radiation probe	x-ray
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
248649 (current)	2020-03-03	cif/ Adding structures of 1557434 via cif-deposit CGI script.	1557434.cif