Crystallography Open Database

Information card for entry 4325879

Preview

Coordinates	4325879.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H32 N8 O18 S Zn3
Calculated formula	C25 H20 N8 O18 S Zn3
Title of publication	Formation of Zn(II) and Cd(II) Coordination Polymers Assembled by Triazine-Based Polycarboxylate and in-Situ-Generated Pyridine-4-thiolate or Dipyridylsulfide Ligands: Observation of an Unusual Luminescence Thermochromism
Authors of publication	Qilong Zhu; Tianlu Sheng; Chunhong Tan; Shengmin Hu; Ruibiao Fu; Xintao Wu
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	7618 - 7624
a	10.4882 ± 0.0004 Å
b	19.2987 ± 0.0007 Å
c	18.1601 ± 0.0008 Å
α	90°
β	92.285 ± 0.003°
γ	90°
Cell volume	3672.8 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0703
Residual factor for significantly intense reflections	0.0631
Weighted residual factors for significantly intense reflections	0.1838
Weighted residual factors for all reflections included in the refinement	0.1943
Goodness-of-fit parameter for all reflections included in the refinement	1.083
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
179361 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/58.	4325879.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4325879.cif
46915	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4325879 via cif-deposit CGI script.	4325879.cif