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7-Diethyl-amino-2-oxo-2H-chromene-3-carbaldehyde.

ABSTRACT: In the title compound, C(14)H(15)NO(3), all non-H atoms except for those of the methyl and the disordered ethyl groupare approximately co-planar, the largest deviation from the mean plane being 0.0223?(13)?Å at the N atom. In the crystal, the packing of mol-ecules through weak inter-molecular C-H?O hydrogen-bonding inter-actions leads to the formation of layers parallel to bc plane. Within these layers, there exist slipped ?-? stacking inter-actions between symmetry-related fused rings [centroid-centroid distances = 3.527?(3) and 3.554?(3), slippage = 0.988 and 1.011?Å, respectively]. One ethyl group is disordered over two sets of sites with site-occupation factors of 0.54 and 0.46.

SUBMITTER: Li HD

PROVIDER: S-EPMC3151821 | biostudies-other | 2011 Jul

REPOSITORIES: biostudies-other

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7-Diethyl-amino-2-oxo-2H-chromene-3-carbaldehyde.

Li Hong-Da HD Yin Bing-Zhu BZ

Acta crystallographica. Section E, Structure reports online 20110618 Pt 7

In the title compound, C(14)H(15)NO(3), all non-H atoms except for those of the methyl and the disordered ethyl groupare approximately co-planar, the largest deviation from the mean plane being 0.0223 (13) Å at the N atom. In the crystal, the packing of mol-ecules through weak inter-molecular C-H⋯O hydrogen-bonding inter-actions leads to the formation of layers parallel to bc plane. Within these layers, there exist slipped π-π stacking inter-actions between symmetry-related fused rings [centroid ...[more]

PMID: 21837106

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