Crystallography Open Database

Information card for entry 4345160

Preview

Coordinates	4345160.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H24 Er2 N6 O21
Calculated formula	C18 H6 Er2 N6 O21
Title of publication	Photoluminescent and Slow Magnetic Relaxation Studies on Lanthanide(III)-2,5-pyrazinedicarboxylate Frameworks.
Authors of publication	Marinho, Maria Vanda; Reis, Daniella O.; Oliveira, Willian X. C.; Marques, Lippy F.; Stumpf, Humberto O.; Déniz, Mariadel; Pasán, Jorge; Ruiz-Pérez, Catalina; Cano, Joan; Lloret, Francesc; Julve, Miguel
Journal of publication	Inorganic chemistry
Year of publication	2017
Journal volume	56
Journal issue	4
Pages of publication	2108 - 2123
a	6.0327 ± 0.0002 Å
b	12.7752 ± 0.0004 Å
c	13.1775 ± 0.0005 Å
α	118.99 ± 0.004°
β	90.575 ± 0.003°
γ	91.67 ± 0.002°
Cell volume	887.61 ± 0.06 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	0.0302
Residual factor for significantly intense reflections	0.0283
Weighted residual factors for significantly intense reflections	0.0826
Weighted residual factors for all reflections included in the refinement	0.0834
Goodness-of-fit parameter for all reflections included in the refinement	1.112
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
193426 (current)	2017-03-04	cif/ Updating files of 4345159, 4345160, 4345161 Original log message: Adding full bibliography for 4345159--4345161.cif.	4345160.cif
191771	2017-02-05	cif/ Adding structures of 4345160 via cif-deposit CGI script.	4345160.cif