Crystallography Open Database

Information card for entry 7133322

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Coordinates	7133322.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H62 Na2 O8
Calculated formula	C48 H62 Na2 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	11.0913 ± 0.0001 Å
b	13.2818 ± 0.0001 Å
c	15.8392 ± 0.0001 Å
α	90°
β	105.146 ± 0.001°
γ	90°
Cell volume	2252.26 ± 0.03 Å³
Cell temperature	199.98 ± 0.1 K
Ambient diffraction temperature	199.98 ± 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	0.046
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for significantly intense reflections	0.1089
Weighted residual factors for all reflections included in the refinement	0.111
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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