Crystallography Open Database

Information card for entry 7214019

Preview

Coordinates	7214019.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H10 Li2 O10
Calculated formula	C8 H10 Li2 O10
Title of publication	Metal‒organic frameworks built from alkali metal ions (Li±-Cs+) and 1,2,3,4-cyclobutanetetracarboxylic acid
Authors of publication	Thuéry, Pierre
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	9
Pages of publication	1724
a	4.9227 ± 0.0002 Å
b	13.9837 ± 0.0003 Å
c	15.7876 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1086.78 ± 0.05 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	4
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0329
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0881
Weighted residual factors for all reflections included in the refinement	0.0895
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
180471 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/40.	7214019.cif
105224	2014-03-11	cif/ Adding structures of 7214019, 7214020, 7214021, 7214022, 7214023, 7214024, 7214025 via cif-deposit CGI script.	7214019.cif