Crystallography Open Database

Information card for entry 7206315

7206314 << 7206315 >> 7206316

Preview

Coordinates	7206315.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H17 Br N4 Ni O4
Calculated formula	C18 H17 Br N4 Ni O4
Title of publication	Syntheses and characterization of nickel(ii) and cobalt(ii) coordination polymers based on 5-bromoisophthalate anion and bis(imidazole) ligands
Authors of publication	Ma, Lu-Fang; Li, Xiu-Qin; Wang, Li-Ya; Hou, Hong-Wei
Journal of publication	CrystEngComm
Year of publication	2011
Journal volume	13
Journal issue	14
Pages of publication	4625
a	10.1385 ± 0.001 Å
b	17.0608 ± 0.0017 Å
c	21.875 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3783.7 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0588
Residual factor for significantly intense reflections	0.0348
Weighted residual factors for significantly intense reflections	0.0671
Weighted residual factors for all reflections included in the refinement	0.0771
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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
180394 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/63.	7206315.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7206315.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7206315.cif
23595	2011-08-09	../uploads/cif-deposit/cod/cif Adding structures of 7206312, 7206313, 7206314, 7206315 via cif-deposit CGI script.	7206315.cif