Crystallography Open Database

Information card for entry 7702960

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Coordinates	7702960.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H42 Li6 O18
Calculated formula	C48 H42 Li6 O18
Title of publication	Use of lithium aryloxides as promoters for preparation of α-hydroxy acid esters.
Authors of publication	Petrus, Rafał; Fałat, Patryk; Sobota, Piotr
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	3
Pages of publication	866 - 876
a	8.183 ± 0.004 Å
b	12.029 ± 0.006 Å
c	13.174 ± 0.008 Å
α	65.36 ± 0.02°
β	75.12 ± 0.02°
γ	84.37 ± 0.02°
Cell volume	1139.1 ± 1.1 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.1065
Residual factor for significantly intense reflections	0.0635
Weighted residual factors for significantly intense reflections	0.1313
Weighted residual factors for all reflections included in the refinement	0.1559
Goodness-of-fit parameter for all reflections included in the refinement	1.034
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
247753 (current)	2020-02-04	cif/ Updating files of 7702960, 7702961, 7702962 Original log message: Adding full bibliography for 7702960--7702962.cif.	7702960.cif
245197	2019-12-15	cif/ Adding structures of 7702960, 7702961, 7702962 via cif-deposit CGI script.	7702960.cif