Crystallography Open Database

Information card for entry 7133321

Preview

Coordinates	7133321.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H62 K2 O8
Calculated formula	C48 H62 K2 O8
Title of publication	Tetraphenylpentalenide organolanthanide complexes
Authors of publication	Katzer, Nicholas; Kaur, M.; Sen, Asmita; Nimaiyar, Rupal; Autschbach, Jochen; Arnold, Polly Louise; Hintermair, Ulrich
Journal of publication	Chemical Communications
Year of publication	2024
a	11.1442 ± 0.0001 Å
b	13.0688 ± 0.0001 Å
c	16.746 ± 0.0001 Å
α	90°
β	106.828 ± 0.001°
γ	90°
Cell volume	2334.47 ± 0.03 Å³
Cell temperature	200 ± 0.1 K
Ambient diffraction temperature	200 ± 0.1 K
Number of distinct elements	4
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	0.0362
Residual factor for significantly intense reflections	0.0347
Weighted residual factors for significantly intense reflections	0.098
Weighted residual factors for all reflections included in the refinement	0.0995
Goodness-of-fit parameter for all reflections included in the refinement	1.103
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7133321.html