Crystallography Open Database

Information card for entry 7219447

7219446 << 7219447 >> 7219448

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Coordinates	7219447.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H34 Cd2 N12 O6
Calculated formula	C34 H34 Cd2 N12 O6
Title of publication	Luminescent MOF Material based on Cadmium(II) and Mixed Ligands: Application for Sensing Volatile Organic Solvent Molecules
Authors of publication	Wang, Dongmei; Zhang, Lirong; Li, Guanghua; Huo, Qisheng; Liu, Yunling
Journal of publication	RSC Adv.
Year of publication	2015
a	23.984 ± 0.005 Å
b	13.122 ± 0.003 Å
c	11.917 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	3750.5 ± 1.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.064
Residual factor for significantly intense reflections	0.0401
Weighted residual factors for significantly intense reflections	0.0844
Weighted residual factors for all reflections included in the refinement	0.0919
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
180525 (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 7/21/94.	7219447.cif
130282	2015-02-03	cif/ Adding structures of 7219447 via cif-deposit CGI script.	7219447.cif