Crystallography Open Database

Information card for entry 1520081

1520080 << 1520081 >> 1520082

Preview

Coordinates	1520081.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H19 N2 O11 Zn1.5
Calculated formula	C17 H19 N2 O11 Zn1.5
Title of publication	Three luminescent metal‒organic frameworks constructed from trinuclear zinc(ii) clusters and furan-2,5-dicarboxylate
Authors of publication	Li, Huan-Huan; Niu, Zheng; Chen, Long; Jiang, Hao-Bin; Wang, Ya-Ping; Cheng, Peng
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	27
Pages of publication	5101
a	9.3468 ± 0.0012 Å
b	15.2267 ± 0.0008 Å
c	17.6517 ± 0.0008 Å
α	90°
β	95.599 ± 0.008°
γ	90°
Cell volume	2500.2 ± 0.4 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 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	0.1169
Residual factor for significantly intense reflections	0.0875
Weighted residual factors for significantly intense reflections	0.2335
Weighted residual factors for all reflections included in the refinement	0.2587
Goodness-of-fit parameter for all reflections included in the refinement	1.057
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176429 (current)	2016-02-13	cif/ (antanas@kurmis) Replacing _cod_chemical_formula_sum_orig tag with _cod_original_formula_sum tag in multiple entries since the replaced tag is deprecated according to the COD CIF dictionary.	1520081.cif
143432	2015-07-10	cif/ Updating files of 1520079, 1520080, 1520081 Original log message: Adding full bibliography for 1520079--1520081.cif.	1520081.cif
137517	2015-05-29	cif/ Adding structures of 1520079, 1520080, 1520081 via cif-deposit CGI script.	1520081.cif