Crystallography Open Database

Information card for entry 7219563

7219562 << 7219563 >> 7219564

Preview

Coordinates	7219563.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H24 Cu4 N6 O18
Calculated formula	C24 H24 Cu4 N6 O18
Title of publication	Construction of Cu(ii), Zn(ii) and Cd(ii) metal‒organic frameworks of bis(1,2,4-triazol-4-yl)ethane and benzenetricarboxylate: syntheses, structures and photocatalytic properties
Authors of publication	Peng, Yan-Fen; Zhao, Shan; Li, Ke; Liu, Lu; Li, Bao-Long; Wu, Bing
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	12
Pages of publication	2544
a	7.516 ± 0.004 Å
b	13.068 ± 0.006 Å
c	14.645 ± 0.007 Å
α	90°
β	99.759 ± 0.011°
γ	90°
Cell volume	1417.6 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0905
Residual factor for significantly intense reflections	0.0645
Weighted residual factors for significantly intense reflections	0.1527
Weighted residual factors for all reflections included in the refinement	0.1762
Goodness-of-fit parameter for all reflections included in the refinement	1.074
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180526 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/95.	7219563.cif
134921	2015-04-06	cif/ Updating files of 7219563, 7219564, 7219565 Original log message: Adding full bibliography for 7219563--7219565.cif.	7219563.cif
131903	2015-02-17	cif/ Adding structures of 7219563, 7219564, 7219565 via cif-deposit CGI script.	7219563.cif