Crystallography Open Database

Information card for entry 4501224

Preview

Coordinates	4501224.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H20 O24 Zn4
Calculated formula	C37 H20 O24 Zn4
Title of publication	Designed 4,8-Connected Metal‒Organic Frameworks Based on Tetrapodal Octacarboxylate Ligands
Authors of publication	Lin, Zu-Jin; Liu, Tian-Fu; Zhao, Xiu-Ling; Lü, Jian; Cao, Rong
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	10
Pages of publication	4284
a	12.4105 ± 0.0005 Å
b	26.2172 ± 0.0012 Å
c	26.2215 ± 0.0012 Å
α	90°
β	90°
γ	90°
Cell volume	8531.7 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	57
Hermann-Mauguin space group symbol	P b c m
Hall space group symbol	-P 2c 2b
Residual factor for all reflections	0.0829
Residual factor for significantly intense reflections	0.0761
Weighted residual factors for significantly intense reflections	0.2367
Weighted residual factors for all reflections included in the refinement	0.2488
Goodness-of-fit parameter for all reflections included in the refinement	1.144
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
179543 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/12.	4501224.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4501224.cif
34818	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4501223, 4501224, 4501225 via cif-deposit CGI script.	4501224.cif