Crystallography Open Database

Information card for entry 2000626

2000625 << 2000626 >> 2000627

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Coordinates	2000626.cif
Original IUCr paper	HTML

Structure parameters

Formula	C18 H20 O5
Calculated formula	C18 H20 O5
SMILES	O1COc2cc(c(OCCO)cc12)C(C)c1ccc(OC)cc1
Title of publication	Structure of 5-(2-hydroxyethoxy)-6-[1-(4-methoxyphenyl)ethyl]-1,3-benzodioxole
Authors of publication	Sicheri, F. V.; Derry, W. B.; Gupta, R. S.; Yang, D. S.-C.
Journal of publication	Acta Crystallographica Section C
Year of publication	1992
Journal volume	48
Journal issue	9
Pages of publication	1687 - 1689
a	16.8 ± 0.002 Å
b	20.071 ± 0.002 Å
c	9.429 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	3179.4 ± 0.6 Å³
Number of distinct elements	3
Hermann-Mauguin space group symbol	P b c a
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	Cu
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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