Crystallography Open Database

Information card for entry 1560520

Preview

Coordinates	1560520.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H26 N2 O7 Zn
Calculated formula	C34 H26 N2 O7 Zn
SMILES	[Zn]1([n]2cccc3ccc4ccc[n]1c4c23)([OH2])OC(=O)c1ccc(cc1)OCc1ccccc1COc1ccc(cc1)C(=O)O[Zn]1([n]2cccc3ccc4ccc[n]1c4c23)([OH2])OC(=O)c1ccc(cc1)OCc1ccccc1COc1ccc(cc1)C(=O)[O-]
Title of publication	A family of entangled coordination polymers constructed from a flexible V-shaped long bicarboxylic acid and auxiliary N-donor ligands: Luminescent sensing
Authors of publication	Wang, Jun; Bai, Chao; Hu, Huai-Ming; Yuan, Fei; Xue, Gang-Lin
Journal of publication	Journal of Solid State Chemistry
Year of publication	2017
Journal volume	249
Pages of publication	87 - 97
a	8.6462 ± 0.0011 Å
b	10.8124 ± 0.0014 Å
c	16.269 ± 0.002 Å
α	79.092 ± 0.002°
β	81.104 ± 0.002°
γ	75.777 ± 0.002°
Cell volume	1438.3 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0596
Residual factor for significantly intense reflections	0.0446
Weighted residual factors for significantly intense reflections	0.1085
Weighted residual factors for all reflections included in the refinement	0.1168
Goodness-of-fit parameter for all reflections included in the refinement	1.035
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
279031 (current)	2022-11-07	cif/1 Fixing some Z values and formulae.	1560520.cif
262131	2021-02-22	cif/ Adding structures of 1560520, 1560521, 1560522 via cif-deposit CGI script.	1560520.cif