Crystallography Open Database

Information card for entry 1568124

Preview

Coordinates	1568124.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H36 Br2 Eu N2 O6
Calculated formula	C18 H36 Br2 Eu N2 O6
SMILES	[Eu]1234567(Br)[O]8CC[N]96CC[O]3CC[O]2CC[N]7(CC[O]1CC8)CC[O]5CC[O]4CC9.[Br-]
Title of publication	4f → 3d sensitization: a luminescent Eu<sup>II</sup>-Mn<sup>II</sup> heteronuclear complex with a near-unity quantum yield.
Authors of publication	Yu, Gang; Liu, Huanyu; Yan, Wenchao; Guo, Ruoyao; Wu, Aoben; Zhao, Zifeng; Liu, Zhiwei; Bian, Zuqiang
Journal of publication	Materials horizons
Year of publication	2023
Journal volume	10
Journal issue	2
Pages of publication	625 - 631
a	13.6795 ± 0.0003 Å
b	17.7174 ± 0.0003 Å
c	9.9143 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	2402.88 ± 0.08 Å³
Cell temperature	179.99 ± 0.1 K
Ambient diffraction temperature	179.99 ± 0.1 K
Number of distinct elements	6
Space group number	18
Hermann-Mauguin space group symbol	P 21 21 2
Hall space group symbol	P 2 2ab
Residual factor for all reflections	0.0218
Residual factor for significantly intense reflections	0.0196
Weighted residual factors for significantly intense reflections	0.0382
Weighted residual factors for all reflections included in the refinement	0.0387
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation probe	x-ray
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
281623 (current)	2023-03-04	cif/ Updating files of 1568124, 1568125, 1568126, 1568127 Original log message: Adding full bibliography for 1568124--1568127.cif.	1568124.cif
279897	2022-12-15	cif/ Adding structures of 1568124, 1568125, 1568126, 1568127 via cif-deposit CGI script.	1568124.cif