Crystallography Open Database

Information card for entry 7209245

7209244 << 7209245 >> 7209246

Preview

Coordinates	7209245.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C46 H46 N18 O9 Zn2
Calculated formula	C46 H46 N18 O9 Zn2
Title of publication	Syntheses, structures and photoluminescent properties of Zn(ii) and Cd(ii) coordination polymers with flexible tripodal triazole-containing ligands
Authors of publication	Liu, Ying-Ying; Liu, Hai-Yan; Ma, Jian-Fang; Yang, Yan; Yang, Jin
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	10
Pages of publication	1897
a	9.6371 ± 0.0011 Å
b	11.5022 ± 0.0014 Å
c	13.0554 ± 0.0018 Å
α	72.255 ± 0.012°
β	84.177 ± 0.01°
γ	67.195 ± 0.011°
Cell volume	1270.3 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0986
Residual factor for significantly intense reflections	0.0676
Weighted residual factors for significantly intense reflections	0.177
Weighted residual factors for all reflections included in the refinement	0.2003
Goodness-of-fit parameter for all reflections included in the refinement	1.011
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180423 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/92.	7209245.cif
75542	2013-03-10	cif/ Adding structures of 7209240, 7209241, 7209242, 7209243, 7209244, 7209245, 7209246 via cif-deposit CGI script.	7209245.cif