Unknown

Dataset Information

0

1-(1,3-Benzodioxol-5-yl)ethanone.

ABSTRACT: In the title compound, C(9)H(8)O(3), the dihedral angle between the mean planes of the benzene and dioxole rings is 1.4?(8)°, with the dioxole group in a slightly distorted envelope configuration with the flap C atom displaced by 0.0645?Å from the plane through the other four atoms. In the crystal, weak inter-molecular C-H?O hydrogen-bond inter-actions link the mol-ecules into chains propagating in [011]. The crystal packing exhibits weak ?-? inter-actions as evidenced by the relatively short distances [3.801?(9)?Å] between the centroids of adjacent benzene rings.

SUBMITTER: Jasinski JP 

PROVIDER: S-EPMC2979689 | biostudies-literature | 2010 Jan

REPOSITORIES: biostudies-literature

Json Xml
altmetric image

Publications

1-(1,3-Benzodioxol-5-yl)ethanone.

Jasinski Jerry P JP   Butcher Ray J RJ   Hakim Al-Arique Q N M QN   Yathirajan H S HS   Narayana B B  

Acta crystallographica. Section E, Structure reports online 20100116 Pt 2

In the title compound, C(9)H(8)O(3), the dihedral angle between the mean planes of the benzene and dioxole rings is 1.4 (8)°, with the dioxole group in a slightly distorted envelope configuration with the flap C atom displaced by 0.0645 Å from the plane through the other four atoms. In the crystal, weak inter-molecular C-H⋯O hydrogen-bond inter-actions link the mol-ecules into chains propagating in [011]. The crystal packing exhibits weak π-π inter-actions as evidenced by the relatively short di  ...[more]

Similar Datasets

Unknown 1-[5-(2H-1,3-Benzodioxol-5-yl)-3-(4-methyl-phen-yl)-2-pyrazolin-1-yl]ethanone.
| S-EPMC3648258 | biostudies-literature
Unknown 1-(2H-1,3-Benzodioxol-5-yl)ethanone thio-semicarbazone.
| S-EPMC3647843 | biostudies-other
Unknown 2-(2H-1,3-Benzodioxol-5-yl)-1,3-benzo-thia-zole.
| S-EPMC3343939 | biostudies-literature
Unknown 2-(1,3-Benzodioxol-5-yl)-1H-benzimid-azole.
| S-EPMC3998317 | biostudies-literature
Unknown {[(E)-(1,3-Benzodioxol-5-yl)methyl­idene]amino}thio­urea
| S-EPMC10848994 | biostudies-literature
Unknown Bis{4-[(1,3-benzodioxol-5-yl)meth-yl]piperazin-1-yl}methane.
| S-EPMC3884327 | biostudies-literature
Unknown 2-{4-[(1,3-Benzodioxol-5-yl)meth-yl]piperazin-1-yl}pyrimidine.
| S-EPMC3770405 | biostudies-literature
Unknown N-[2-(1,3-Benzodioxol-5-yl)eth-yl]-2-chloro-acetamide.
| S-EPMC2961617 | biostudies-literature
Unknown 2,2-Dimethyl-1,3-benzodioxol-4-yl N-methyl-carbamate.
| S-EPMC2983127 | biostudies-literature
Unknown 1,2-Bis[(1,3-benzodioxol-5-yl)methyl-idene]hydrazine.
| S-EPMC3254287 | biostudies-literature