Crystallography Open Database

Information card for entry 7207544

7207543 << 7207544 >> 7207545

Preview

Coordinates	7207544.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H52 N22 O17 Zn2
Calculated formula	C51 H42 N22 O17 Zn2
Title of publication	Synthesis, structure, fluorescent and magnetic properties of a series of coordination polymers based on a long and flexible bis-triazole ligand
Authors of publication	Wang, Nan; Feng, Yue-Chao; Shi, Wei; Zhao, Bin; Cheng, Peng; Liao, Dai-Zheng; Yan, Shi-Ping
Journal of publication	CrystEngComm
Year of publication	2012
Journal volume	14
Journal issue	8
Pages of publication	2769
a	19.756 ± 0.003 Å
b	16.208 ± 0.002 Å
c	19.19 ± 0.003 Å
α	90°
β	98.206 ± 0.004°
γ	90°
Cell volume	6081.8 ± 1.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.1318
Residual factor for significantly intense reflections	0.0975
Weighted residual factors for significantly intense reflections	0.2572
Weighted residual factors for all reflections included in the refinement	0.2825
Goodness-of-fit parameter for all reflections included in the refinement	1.048
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180406 (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 7/20/75.	7207544.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7207544.cif
52031	2012-04-07	../uploads/cif-deposit/cod/cif Adding structures of 7207539, 7207540, 7207541, 7207542, 7207543, 7207544 via cif-deposit CGI script.	7207544.cif