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2-(6-Chloro-1H-indol-3-yl)acetonitrile.

ABSTRACT: In the title compound, C(10)H(7)ClN(2), the carbonitrile group is twisted away from the plane of the indole ring system [C(cy)-C(me)-C(ar)-C(ar) = -44.7?(8)°; cy = cyanide, me = methyl-ene and ar = aromatic]. In the crystal, N-H?N hydrogen bonds link the mol-ecules into C(7) chains propagating in [010]. Aromatic ?-? stacking inter-actions [minimum centroid-centroid separation = 3.663?(3)?Å] are also observed.

SUBMITTER: Li JF

PROVIDER: S-EPMC3254487 | biostudies-literature | 2012 Jan

REPOSITORIES: biostudies-literature

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2-(6-Chloro-1H-indol-3-yl)acetonitrile.

Li Jin-Feng JF Luo Yang-Hui YH

Acta crystallographica. Section E, Structure reports online 20111217 Pt 1

In the title compound, C(10)H(7)ClN(2), the carbonitrile group is twisted away from the plane of the indole ring system [C(cy)-C(me)-C(ar)-C(ar) = -44.7 (8)°; cy = cyanide, me = methyl-ene and ar = aromatic]. In the crystal, N-H⋯N hydrogen bonds link the mol-ecules into C(7) chains propagating in [010]. Aromatic π-π stacking inter-actions [minimum centroid-centroid separation = 3.663 (3) Å] are also observed. ...[more]

PMID: 22259430

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