Crystallography Open Database

Information card for entry 7029460

Preview

Coordinates	7029460.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H14 Li O11 Y
Calculated formula	C16 H14 Li O11 Y
Title of publication	A metal-organic framework assembled from Y(iii), Li(i), and terephthalate: hydrothermal synthesis, crystal structure, thermal decomposition and topological studies.
Authors of publication	Abdelbaky, Mohammed S. M.; Amghouz, Zakariae; García-Granda, Santiago; García, José R
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	15
Pages of publication	5739 - 5746
a	11.6415 ± 0.0007 Å
b	16.092 ± 0.0004 Å
c	13.2243 ± 0.0008 Å
α	90°
β	132.228 ± 0.011°
γ	90°
Cell volume	1834.4 ± 0.4 Å³
Cell temperature	294 ± 2 K
Ambient diffraction temperature	294 ± 2 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	0.0901
Residual factor for significantly intense reflections	0.0432
Weighted residual factors for significantly intense reflections	0.0806
Weighted residual factors for all reflections included in the refinement	0.0972
Goodness-of-fit parameter for all reflections included in the refinement	1.011
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
180000 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/94.	7029460.cif
108310	2014-03-30	cif/ Adding structures of 7029460 via cif-deposit CGI script.	7029460.cif