Crystallography Open Database

Information card for entry 7209697

7209696 << 7209697 >> 7209698

Preview

Coordinates	7209697.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H7 Cd0.5 I N7
Calculated formula	C9 H7 Cd0.5 I N7
Title of publication	Hydrothermal syntheses and characterization of a series of luminescent Cd(ii) frameworks with pyridine-based and benzene-based bis-triazole ligands
Authors of publication	Ding, Bin; Yang, Pan; Liu, Yuan Yuan; Wang, Ying; Du, Gui Xiang
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	13
Pages of publication	2490
a	18.3342 ± 0.0006 Å
b	7.6172 ± 0.0002 Å
c	16.7658 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	2341.43 ± 0.14 Å³
Cell temperature	116 ± 1 K
Ambient diffraction temperature	116 ± 1 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0545
Residual factor for significantly intense reflections	0.0323
Weighted residual factors for significantly intense reflections	0.0611
Weighted residual factors for all reflections included in the refinement	0.0714
Goodness-of-fit parameter for all reflections included in the refinement	1.097
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
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7209697.cif
86074	2013-05-09	cif/ Adding structures of 7209697, 7209698, 7209699, 7209700, 7209701, 7209702, 7209703, 7209704 via cif-deposit CGI script.	7209697.cif