Crystallography Open Database

Information card for entry 4510009

Preview

Coordinates	4510009.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H6 Er N O7
Calculated formula	C9 H6 Er N O7
Title of publication	Synthesis, Crystal Structures, and Solid-State Luminescent Properties of Diverse Ln‒Pyridine-3,5-Dicarboxylate Coordination Polymers Modulated by the Ancillary Ligand
Authors of publication	Wang, Xiao; Zhai, Quan-Guo; Li, Shu-Ni; Jiang, Yu-Cheng; Hu, Man-Cheng
Journal of publication	Crystal Growth & Design
Year of publication	2014
Journal volume	14
Journal issue	1
Pages of publication	177
a	7.6082 ± 0.0003 Å
b	17.0721 ± 0.0004 Å
c	8.2971 ± 0.0003 Å
α	90°
β	104.215 ± 0.004°
γ	90°
Cell volume	1044.7 ± 0.06 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.0449
Residual factor for significantly intense reflections	0.0407
Weighted residual factors for significantly intense reflections	0.1002
Weighted residual factors for all reflections included in the refinement	0.1043
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
179647 (current)	2016-03-24	cif/4/51/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/51/00.	4510009.cif
104173	2014-03-10	cif/ Adding structures of 4510009 via cif-deposit CGI script.	4510009.cif