Crystallography Open Database

Information card for entry 7037401

Preview

Coordinates	7037401.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H40 N8 O11 Zn2
Calculated formula	C42 H40 N8 O11 Zn2
Title of publication	Hydrothermal synthesis and structural characterization of metal-organic frameworks based on new tetradentate ligands.
Authors of publication	Liang, Yue; Yuan, Wei-Guan; Zhang, Shu-Fang; He, Zhan; Xue, Junru; Zhang, Xia; Jing, Lin-Hai; Qin, Da-Bin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	4
Pages of publication	1382 - 1390
a	13.053 ± 0.008 Å
b	8.067 ± 0.005 Å
c	23.754 ± 0.011 Å
α	90°
β	117.71 ± 0.02°
γ	90°
Cell volume	2214 ± 2 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	0.0561
Residual factor for significantly intense reflections	0.0402
Weighted residual factors for significantly intense reflections	0.1008
Weighted residual factors for all reflections included in the refinement	0.1088
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
176019 (current)	2016-02-05	cif/ Updating files of 7037401, 7037402, 7037403 Original log message: Adding full bibliography for 7037401--7037403.cif.	7037401.cif
170499	2015-11-24	cif/ Adding structures of 7037401, 7037402, 7037403 via cif-deposit CGI script.	7037401.cif