Crystallography Open Database

Information card for entry 7015478

Preview

Coordinates	7015478.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C11 H14 Cd1.5 N O7 P
Calculated formula	C11 H14 Cd1.5 N O7 P
Title of publication	Hydrothermal synthesis, structures, and luminescent properties of zinc(II) and cadmium(II) phosphonates with a 3D framework structure using terephthalate as second linkers.
Authors of publication	Tong, Fei; Sun, Zhen-Gang; Chen, Kai; Zhu, Yan-Yu; Wang, Wei-Nan; Jiao, Cheng-Qi; Wang, Cheng-Lin; Li, Chao
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	18
Pages of publication	5059 - 5065
a	7.7215 ± 0.001 Å
b	9.2893 ± 0.0012 Å
c	9.7711 ± 0.0012 Å
α	104.628 ± 0.001°
β	92.464 ± 0.002°
γ	103.546 ± 0.002°
Cell volume	655.37 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0332
Residual factor for significantly intense reflections	0.031
Weighted residual factors for significantly intense reflections	0.0748
Weighted residual factors for all reflections included in the refinement	0.0762
Goodness-of-fit parameter for all reflections included in the refinement	1.055
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.	7015478.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7015478.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7015478.cif
21164	2011-06-21	../uploads/cif-deposit/cod/cif Adding structures of 7015477, 7015478 via cif-deposit CGI script.	7015478.cif