Crystallography Open Database

Information card for entry 4502745

Preview

Coordinates	4502745.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C204 H182 N24 O37 Zn6
Calculated formula	C204 H181.99 N24 O37 Zn6
Title of publication	Ligand-Directed Construction of Zn(II) Complexes from Zero-Dimensional Metallomacrocycle to One-, Two-, and Three-Dimensional Coordination Polymers Based on N-Donor and β-Diketone Bifunctional Ligands
Authors of publication	Yang, Ping; Wu, Jin-Ji; Zhou, Hai-Yun; Ye, Bao-Hui
Journal of publication	Crystal Growth & Design
Year of publication	2012
Journal volume	12
Journal issue	1
Pages of publication	99
a	23.2562 ± 0.0006 Å
b	23.2562 ± 0.0006 Å
c	62.035 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	29056.6 ± 1.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.1818
Residual factor for significantly intense reflections	0.0685
Weighted residual factors for significantly intense reflections	0.1739
Weighted residual factors for all reflections included in the refinement	0.2321
Goodness-of-fit parameter for all reflections included in the refinement	0.98
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
179558 (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 4/50/27.	4502745.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502745.cif
37746	2012-03-04	../uploads/cif-deposit/cod/cif Adding structures of 4502745 via cif-deposit CGI script.	4502745.cif