Crystallography Open Database

Information card for entry 1512446

Preview

Coordinates	1512446.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C14 H9 N2 O9 Pr
Calculated formula	C14 H7 N2 O9 Pr
Title of publication	Structure and luminescence of a 2-dimensional 2,3-pyridinedicarboxylate coordination polymer constructed from lanthanide(III) dimers
Authors of publication	Amanda L. Ramireza; Karah E. Knopeb; Tanya T. Kelleya; Natalie E. Greiga; Jeffrey D. Einkaufa; Daniel T. de Lill
Journal of publication	Inorganica Chimica Acta
Year of publication	2012
Journal volume	392
Pages of publication	46 - 51
a	12.8364 ± 0.0016 Å
b	16.747 ± 0.002 Å
c	7.0868 ± 0.0009 Å
α	90°
β	97.073 ± 0.002°
γ	90°
Cell volume	1511.9 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	5
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	0.0639
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for significantly intense reflections	0.0955
Weighted residual factors for all reflections included in the refinement	0.1064
Goodness-of-fit parameter for all reflections included in the refinement	0.953
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
176729 (current)	2016-02-18	cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1.	1512446.cif
120071	2014-07-11	Adding DOIs to range 1 structures.	1512446.cif
89375	2013-10-24	cif/ Adding structures of 1512446 via cif-deposit CGI script.	1512446.cif