Crystallography Open Database

Information card for entry 4500348

Preview

Coordinates	4500348.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H22 Co N4 O4
Calculated formula	C20 H22 Co N4 O4
Title of publication	Molecular Tectonics of Entangled Metal−Organic Frameworks Based on Different Conformational Carboxylates Mixed with a Flexible N,N′-Type Ligand
Authors of publication	Liu, Jian-Qiang; Huang, Yun-Sheng; Zhao, Ying-Yong; Jia, Zhen-Bin
Journal of publication	Crystal Growth & Design
Year of publication	2011
Journal volume	11
Journal issue	2
Pages of publication	569
a	9.3917 ± 0.0011 Å
b	14.1197 ± 0.0016 Å
c	15.313 ± 0.0017 Å
α	90°
β	90°
γ	90°
Cell volume	2030.6 ± 0.4 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	5
Space group number	33
Hermann-Mauguin space group symbol	P n a 21
Hall space group symbol	P 2c -2n
Residual factor for all reflections	0.0442
Residual factor for significantly intense reflections	0.0375
Weighted residual factors for significantly intense reflections	0.099
Weighted residual factors for all reflections included in the refinement	0.106
Goodness-of-fit parameter for all reflections included in the refinement	0.86
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
179534 (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 4/50/03.	4500348.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4500348.cif
34461	2012-02-25	../uploads/cif-deposit/cod/cif Adding structures of 4500348, 4500349, 4500350 via cif-deposit CGI script.	4500348.cif