Crystallography Open Database

Information card for entry 7133326

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Coordinates	7133326.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C76 H74 Li O6 Y
Calculated formula	C76 H74 Li O6 Y
Title of publication	Tetraphenylpentalenide organolanthanide complexes.
Authors of publication	Katzer, Nicholas J.; Kaur, Mandeep; Sen, Asmita; Nimaiyar, Rupal; Autschbach, Jochen; Arnold, Polly L.; Hintermair, Ulrich
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2024
Journal volume	60
Journal issue	72
Pages of publication	9749 - 9752
a	10.33655 ± 0.00009 Å
b	25.4845 ± 0.0002 Å
c	23.3833 ± 0.0002 Å
α	90°
β	96.3298 ± 0.0008°
γ	90°
Cell volume	6122.12 ± 0.09 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 0.1 K
Number of distinct elements	5
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	0.0455
Residual factor for significantly intense reflections	0.0413
Weighted residual factors for significantly intense reflections	0.1057
Weighted residual factors for all reflections included in the refinement	0.1096
Goodness-of-fit parameter for all reflections included in the refinement	1.058
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

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