Crystallography Open Database

Information card for entry 7227112

Preview

Coordinates	7227112.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H14 Cl2 N2 O Zn
Calculated formula	C14 H14 Cl2 N2 O Zn
SMILES	[Zn]1([n]2c(cccc2)C(=[N]1c1c(OC)cccc1)C)(Cl)Cl
Title of publication	Luminescent Properties of Zn(II) Supramolecular Framework: Easily Tunable Optical Properties by Variation of the Alkyl Substitution of (E)-N-(Pyridine-2-ylethylidyne)arylamine Ligands
Authors of publication	Dong, Yuwei; Fan, Ruiqing; Chen, Wei; Zhang, Huijie; Song, Yang; Du, Xi; Wang, Ping; Wei, Liguo; Yang, Yulin
Journal of publication	RSC Adv.
Year of publication	2016
a	11.311 ± 0.003 Å
b	9.796 ± 0.003 Å
c	14.305 ± 0.004 Å
α	90°
β	106.827 ± 0.003°
γ	90°
Cell volume	1517.2 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0479
Residual factor for significantly intense reflections	0.0336
Weighted residual factors for significantly intense reflections	0.0807
Weighted residual factors for all reflections included in the refinement	0.0873
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
188456 (current)	2016-11-15	cif/ Adding structures of 7227112, 7227113, 7227114, 7227115, 7227116 via cif-deposit CGI script.	7227112.cif