Crystallography Open Database

Information card for entry 7217117

Preview

Coordinates	7217117.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C15 H10 Br4 N6 O4 Zn
Calculated formula	C15 H10 Br4 N6 O4 Zn
Title of publication	Three mixed-ligand coordination networks modulated by flexible N-donor ligands: syntheses, topological structures, and temperature-sensitive luminescence properties
Authors of publication	Yan, Zhi-Hao; Han, Lu-Lu; Zhao, Ya-Qin; Li, Xiao-Yu; Wang, Xing-Po; Wang, Lei; Sun, Di
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	37
Pages of publication	8747
a	9.6238 ± 0.0008 Å
b	17.24 ± 0.0014 Å
c	12.7886 ± 0.001 Å
α	90°
β	91.914 ± 0.002°
γ	90°
Cell volume	2120.6 ± 0.3 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0618
Residual factor for significantly intense reflections	0.0341
Weighted residual factors for significantly intense reflections	0.0683
Weighted residual factors for all reflections included in the refinement	0.0773
Goodness-of-fit parameter for all reflections included in the refinement	0.955
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
180502 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/71.	7217117.cif
123416	2014-09-08	cif/ Updating files of 7217115, 7217116, 7217117 Original log message: Adding full bibliography for 7217115--7217117.cif.	7217117.cif
120363	2014-07-15	cif/ Adding structures of 7217115, 7217116, 7217117 via cif-deposit CGI script.	7217117.cif