Crystallography Open Database

Information card for entry 8105144

Preview

Coordinates	8105144.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H34 Er2 F12 N4 O12
Calculated formula	C66 H34 Er2 F12 N4 O12
Title of publication	The crystal structure of [(tetra-μ 2-2,6-difluorobenzoato-κ 2 O:O′)-bis-(2,6-difluorobenzoato-κ 2 O:O′)-bis-(1,10-phenanthroline-κ 2 N:N′)]dierbium(III) C66H34N4O12F12Er2
Authors of publication	Yu-Fei, Zhong; Wen-Min, Wang; Xiong-Xin, Peng; Guang-Ming, Bao; Chun-Yan, Hu; Hou-Qun, Yuan
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2020
Journal volume	235
Journal issue	2
Pages of publication	473 - 475
a	11.8934 ± 0.0005 Å
b	12.0041 ± 0.0004 Å
c	12.4578 ± 0.0005 Å
α	68.718 ± 0.004°
β	64.205 ± 0.004°
γ	87.053 ± 0.003°
Cell volume	1480.09 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0426
Residual factor for significantly intense reflections	0.0326
Weighted residual factors for significantly intense reflections	0.0577
Weighted residual factors for all reflections included in the refinement	0.0626
Goodness-of-fit parameter for all reflections included in the refinement	1.061
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
274887 (current)	2022-05-04	cif/ Adding structures of 8105144 via cif-deposit CGI script.	8105144.cif