Crystallography Open Database

Information card for entry 4333576

Preview

Coordinates	4333576.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H6 O19 Zn4
Calculated formula	C36 H6 O19 Zn4
Title of publication	A Straight Forward Route for the Development of Metal-Organic Frameworks Functionalized with Aromatic -OH Groups: Synthesis, Characterization, and Gas (N2, Ar, H2, CO2, CH4, NH3) Sorption Properties
Authors of publication	Ioannis Spanopoulos; Pantelis Xydias; Christos D. Malliakas; Pantelis N. Trikalitis
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	855 - 862
a	30.174 ± 0.002 Å
b	30.174 ± 0.002 Å
c	30.174 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	27473 ± 3 Å³
Cell temperature	250 ± 2 K
Ambient diffraction temperature	250 ± 2 K
Number of distinct elements	4
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.1759
Residual factor for significantly intense reflections	0.0961
Weighted residual factors for significantly intense reflections	0.2487
Weighted residual factors for all reflections included in the refinement	0.2998
Goodness-of-fit parameter for all reflections included in the refinement	0.946
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
179438 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/35.	4333576.cif
99371	2014-01-31	cif/ Adding structures of 4333576 via cif-deposit CGI script.	4333576.cif