Crystallography Open Database

Information card for entry 7020984

7020983 << 7020984 >> 7020985

Preview

Coordinates	7020984.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Compound 2
Formula	C34 H32 Li2 O9
Calculated formula	C34 H32 Li2 O9
Title of publication	New structural motifs in lithium and zinc calix[4]arene chemistry.
Authors of publication	Redshaw, Carl; Rowe, Oliver; Hughes, David L.; Fuller, Anna-Marie; Ibarra, Ilich A.; Humphrey, Simon M.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	6
Pages of publication	1983 - 1986
a	10.3639 ± 0.0007 Å
b	11.7721 ± 0.0005 Å
c	11.8355 ± 0.0008 Å
α	87.429 ± 0.004°
β	78.483 ± 0.003°
γ	83.793 ± 0.004°
Cell volume	1406.22 ± 0.15 Å³
Cell temperature	120 ± 2 K
Ambient diffraction temperature	120 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1406
Residual factor for significantly intense reflections	0.0794
Weighted residual factors for significantly intense reflections	0.1669
Weighted residual factors for all reflections included in the refinement	0.1918
Goodness-of-fit parameter for all reflections included in the refinement	1.066
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
179914 (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 7/02/09.	7020984.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7020984.cif
73739	2013-02-21	cif/ Adding structures of 7020983, 7020984, 7020985 via cif-deposit CGI script.	7020984.cif