Crystallography Open Database

Information card for entry 7019146

7019145 << 7019146 >> 7019147

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Coordinates	7019146.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C171 H195 F12 Li12 O24
Calculated formula	C171 H195 F12 Li12 O24
Title of publication	Lithium phenolates with a hexagonal-prismatic Li(6)O(6) core isolated via a cage-shaped tripodal ligands system: crystal structures and their behavior in solution.
Authors of publication	Nakajima, Hideto; Yasuda, Makoto; Baba, Akio
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2012
Journal volume	41
Journal issue	22
Pages of publication	6602 - 6606
a	31.5198 ± 0.0006 Å
b	16.6893 ± 0.0003 Å
c	31.2344 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	16430.6 ± 0.5 Å³
Cell temperature	253 ± 2 K
Ambient diffraction temperature	253 ± 2 K
Number of distinct elements	5
Space group number	54
Hermann-Mauguin space group symbol	P c c a
Hall space group symbol	-P 2a 2ac
Residual factor for all reflections	0.0986
Residual factor for significantly intense reflections	0.0784
Weighted residual factors for significantly intense reflections	0.2378
Weighted residual factors for all reflections included in the refinement	0.2628
Goodness-of-fit parameter for all reflections included in the refinement	1.054
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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