Crystallography Open Database

Information card for entry 4345159

Preview

Coordinates	4345159.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H13 Ce N3 O11
Calculated formula	C9 H3 Ce N3 O11
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	6.099 ± 0.005 Å
b	10.501 ± 0.005 Å
c	13.688 ± 0.005 Å
α	72.607 ± 0.005°
β	88.789 ± 0.005°
γ	88.98 ± 0.005°
Cell volume	836.3 ± 0.9 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	0.0305
Residual factor for significantly intense reflections	0.0298
Weighted residual factors for significantly intense reflections	0.0819
Weighted residual factors for all reflections included in the refinement	0.0829
Goodness-of-fit parameter for all reflections included in the refinement	1.073
Diffraction radiation wavelength	1.5418 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
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.	4345159.cif
191770	2017-02-05	cif/ Adding structures of 4345159 via cif-deposit CGI script.	4345159.cif