Crystallography Open Database

Information card for entry 7702169

Preview

Coordinates	7702169.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H21 Cl3 Er N3 O9
Calculated formula	C18 H18 Cl3 Er N3 O9
Title of publication	Solvent-modulation of the structure and dimensionality in lanthanoid-anilato coordination polymers.
Authors of publication	Benmansour, Samia; Pérez-Herráez, Irene; Cerezo-Navarrete, Christian; López-Martínez, Gustavo; Martínez Hernández, Cristian; Gómez-García, Carlos J
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	19
Pages of publication	6729 - 6741
a	9.9692 ± 0.0002 Å
b	13.3452 ± 0.0003 Å
c	19.2711 ± 0.0004 Å
α	90°
β	96.955 ± 0.002°
γ	90°
Cell volume	2544.98 ± 0.09 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0588
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.085
Weighted residual factors for all reflections included in the refinement	0.0956
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
236820 (current)	2019-11-24	cif/ Adding structures of 7702168, 7702169, 7702170, 7702171, 7702172, 7702173 via cif-deposit CGI script.	7702169.cif