Crystallography Open Database

Information card for entry 7223753

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Coordinates	7223753.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Li2 anthraquinone-dicarboxylate
Formula	C16 H8 Li2 O7
Calculated formula	C16 H8 Li2 O7
Title of publication	Coordination environments and π-conjugation in dense lithium coordination polymers
Authors of publication	Tominaka, Satoshi; Yeung, Hamish H.-M.; Henke, Sebastian; Cheetham, Anthony K.
Journal of publication	CrystEngComm
Year of publication	2016
Journal volume	18
Journal issue	3
Pages of publication	398
a	18.9997 ± 0.0007 Å
b	9.4546 ± 0.0003 Å
c	7.4275 ± 0.0003 Å
α	90°
β	95.743 ± 0.004°
γ	90°
Cell volume	1327.54 ± 0.08 Å³
Cell temperature	120 ± 0.1 K
Ambient diffraction temperature	120.15 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	0.0621
Residual factor for significantly intense reflections	0.0441
Weighted residual factors for significantly intense reflections	0.1075
Weighted residual factors for all reflections included in the refinement	0.1193
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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