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(E)-4-{2-[(4-Chloro-phen-yl)imino-meth-yl]phen-oxy}phthalonitrile.

ABSTRACT: In the title compound, C(21)H(12)ClN(3)O, the phenoxy ring makes dihedral angles of 51.42?(5) and 65.01?(6)°, respectively, with the chlorophenyl and phthalonitrile rings. In the crystal structure, the mol-ecules are inter-linked through weak C-H?N and C-H?? contacts, and ?-? stacking inter-actions via crystallographic inversion centres form a three-dimensional network. The distance between the centroids of the phthalonitrile rings is 3.9104?(11)Å, with a slippage between the rings of 1.626?Å and a perpendicular distance between the rings of 3.556?Å.

SUBMITTER: Tufekci M

PROVIDER: S-EPMC2977715 | biostudies-other | 2009

REPOSITORIES: biostudies-other

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(E)-4-{2-[(4-Chloro-phen-yl)imino-meth-yl]phen-oxy}phthalonitrile.

Tüfekçi Marife M Alpaslan Gökhan G Erşahin Ferda F Ağar Erbil E Erdönmez Ahmet A

Acta crystallographica. Section E, Structure reports online 20090410 Pt 5

In the title compound, C(21)H(12)ClN(3)O, the phenoxy ring makes dihedral angles of 51.42 (5) and 65.01 (6)°, respectively, with the chlorophenyl and phthalonitrile rings. In the crystal structure, the mol-ecules are inter-linked through weak C-H⋯N and C-H⋯π contacts, and π-π stacking inter-actions via crystallographic inversion centres form a three-dimensional network. The distance between the centroids of the phthalonitrile rings is 3.9104 (11)Å, with a slippage between the rings of 1.626 Å an ...[more]

PMID: 21583851

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