Crystallography Open Database

Information card for entry 8106429

Preview

Coordinates	8106429.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C34 H30 Cl4 Gd2 N8 O14
Calculated formula	C34 H30 Cl4 Gd2 N8 O14
Title of publication	Crystal structure of bis(2,6-dihydroxymethyl)pyridine-κ3 N,O,O′)-bis(μ2-6-chloropyridin-2-olato-κ3 N,O:O)-bis(6-chloropyridin-2-olato-κO)-bis(nitrato-κ2 O,O′)digadolinium(III), C34H30Cl4Gd2N8O14
Authors of publication	Youzhu, Yu; Yuhua, Guo; Liguo, Yang; Yongsheng, Niu
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2017
Journal volume	232
Journal issue	1
Pages of publication	51 - 52
a	8.9118 ± 0.0005 Å
b	20.7857 ± 0.0011 Å
c	11.7642 ± 0.0006 Å
α	90°
β	100.677 ± 0.002°
γ	90°
Cell volume	2141.4 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
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	0.0348
Residual factor for significantly intense reflections	0.0245
Weighted residual factors for significantly intense reflections	0.0774
Weighted residual factors for all reflections included in the refinement	0.1057
Goodness-of-fit parameter for all reflections included in the refinement	1.268
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
280226 (current)	2023-01-06	cif/ Adding structures of 8106429 via cif-deposit CGI script.	8106429.cif