Crystallography Open Database

Information card for entry 7218958

Preview

Coordinates	7218958.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H7 N2 O7 Pr
Calculated formula	C12 H7 N2 O7 Pr
Title of publication	Two- and Three-Dimensional Lanthanide-Based Coordination Polymers Assembled by the Synergistic Effect of Various Lanthanide Radii and Flexibility of a New Binicotinate-Containing Ligand: in Situ Synthesis, Structures, and Properties
Authors of publication	Ji, Baoming; deng, dong sheng; Ma, Junying; Sun, Chaowei; Zhao, Bin
Journal of publication	RSC Adv.
Year of publication	2014
a	17.57 ± 0.003 Å
b	10.6061 ± 0.0015 Å
c	6.9846 ± 0.001 Å
α	90°
β	111.598 ± 0.001°
γ	90°
Cell volume	1210.2 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0153
Residual factor for significantly intense reflections	0.0148
Weighted residual factors for significantly intense reflections	0.0379
Weighted residual factors for all reflections included in the refinement	0.0382
Goodness-of-fit parameter for all reflections included in the refinement	1.086
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
180520 (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 7/21/89.	7218958.cif
128003	2014-11-29	cif/ Adding structures of 7218956, 7218957, 7218958, 7218959, 7218960, 7218961, 7218962, 7218963, 7218964 via cif-deposit CGI script.	7218958.cif