Crystallography Open Database

Information card for entry 7233508

Preview

Coordinates	7233508.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Tris(2,6-dimethyl-3,5-heptanedionate)mono(5-nitro- 1,10-phenanthroline)erbium(III)
Formula	C39 H52 Er N3 O8
Calculated formula	C39 H52 Er N3 O8
Title of publication	Novel erbium(III) complexes with 2,6-dimethyl-3,5-heptanedione and different N,N-donor ligands for ormosil and PMMA matrices doping
Authors of publication	P. Martin-Ramos; V. Lavin; M. Ramos Silva; I. R. Martin; F. Lahoz; P. Chamorro-Posada; J. A. Paixao; J. Martin-Gil
Journal of publication	Journal of Materials Chemistry C
Year of publication	2013
Journal volume	1
Pages of publication	5701 - 5710
a	13.7978 ± 0.0009 Å
b	17.4765 ± 0.0012 Å
c	26.166 ± 0.0017 Å
α	83.044 ± 0.005°
β	79.39 ± 0.005°
γ	88.249 ± 0.005°
Cell volume	6155.9 ± 0.7 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.2784
Residual factor for significantly intense reflections	0.0812
Weighted residual factors for significantly intense reflections	0.1535
Weighted residual factors for all reflections included in the refinement	0.219
Goodness-of-fit parameter for all reflections included in the refinement	0.938
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
217778 (current)	2019-08-28	cif/ Adding structures of 7233508 via cif-deposit CGI script.	7233508.cif