Crystallography Open Database

Information card for entry 4510079

Preview

Coordinates	4510079.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H15 N2 O5 Zn
Calculated formula	C17 H15 N2 O5 Zn
Title of publication	Tuning Different Kinds of Entangled Networks by Varying N-Donor Ligands: From Self-Penetrating to Multi-interpenetrating
Authors of publication	Yang, Jin-Xia; Qin, Ye-Yan; Cheng, Jian-Kai; Yao, Yuan-Gen
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	3
Pages of publication	1047
a	11.5714 ± 0.0005 Å
b	11.5714 ± 0.0005 Å
c	22.773 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	2640.7 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	181
Hermann-Mauguin space group symbol	P 64 2 2
Hall space group symbol	P 64 2 (0 0 2)
Residual factor for all reflections	0.1161
Residual factor for significantly intense reflections	0.0694
Weighted residual factors for significantly intense reflections	0.1921
Weighted residual factors for all reflections included in the refinement	0.2336
Goodness-of-fit parameter for all reflections included in the refinement	0.986
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	4510079.cif
106309	2014-03-15	cif/ Adding structures of 4510079, 4510080, 4510081, 4510082, 4510083 via cif-deposit CGI script.	4510079.cif