Crystallography Open Database

Information card for entry 4507534

Preview

Coordinates	4507534.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H17 N6 O6 Zn
Calculated formula	C20 H17 N6 O6 Zn
Title of publication	Syntheses, Topological Structures, and Photoluminescences of Six New Zn(II) Coordination Polymers Based on Mixed Tripodal Imidazole Ligand and Varied Polycarboxylates
Authors of publication	Sun, Di; Yan, Zhi-Hao; Blatov, Vladislav A.; Wang, Lei; Sun, Dao-Feng
Journal of publication	Crystal Growth & Design
Year of publication	2013
Journal volume	13
Journal issue	3
Pages of publication	1277
a	14.705 ± 0.002 Å
b	15.934 ± 0.003 Å
c	16.796 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	3935.5 ± 1.2 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
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	0.0781
Residual factor for significantly intense reflections	0.052
Weighted residual factors for significantly intense reflections	0.1365
Weighted residual factors for all reflections included in the refinement	0.1555
Goodness-of-fit parameter for all reflections included in the refinement	1.02
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
179611 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/75.	4507534.cif
85555	2013-05-07	cif/ Adding structures of 4507530, 4507531, 4507532, 4507533, 4507534, 4507535 via cif-deposit CGI script.	4507534.cif