Crystallography Open Database

Information card for entry 7215491

Preview

Coordinates	7215491.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C17 H21 Cd N2 O9 P
Calculated formula	C17 H21 Cd N2 O9 P
Title of publication	Syntheses, structures, luminescence and molecular recognition properties of four new cadmium carboxyphosphonates with 2D layered and 3D supramolecular structures
Authors of publication	Dai, Lu-Lu; Zhu, Yan-Yu; Jiao, Cheng-Qi; Sun, Zhen-Gang; Shi, Shao-Ping; Zhou, Wei; Li, Wen-Zhu; Sun, Tong; Luo, Hui; Ma, Ming-Xue
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	23
Pages of publication	5050
a	11.78 ± 0.0011 Å
b	9.4034 ± 0.0009 Å
c	18.8322 ± 0.0018 Å
α	90°
β	103.465 ± 0.002°
γ	90°
Cell volume	2028.7 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 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	0.0651
Residual factor for significantly intense reflections	0.0415
Weighted residual factors for significantly intense reflections	0.1044
Weighted residual factors for all reflections included in the refinement	0.1166
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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
180485 (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 7/21/54.	7215491.cif
116196	2014-06-07	cif/ Updating files of 7215488, 7215489, 7215490, 7215491 Original log message: Adding full bibliography for 7215488--7215491.cif.	7215491.cif
112297	2014-04-30	cif/ Adding structures of 7215488, 7215489, 7215490, 7215491 via cif-deposit CGI script.	7215491.cif