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2-[2-(4-Methyl-piperazin-1-yl)eth-yl]iso-indoline-1,3-dione.

ABSTRACT: In the title compound, C15H19N3O2, the piperazine ring adopts a chair conformation, with its N-C bonds in pseudo-equatorial orientations. The dihedral angle between the C atoms of the piperazine ring and the phthalamide ring system (r.m.s. deviaiton = 0.008?Å) is 89.30?(8)°. In the crystal, mol-ecules are linked by C-H?O hydrogen bonds, generating a three-dimensional network and aromatic ?-? inter-actions also occur [centroid-centroid distances = 3.556?(1)-3.716?(1)?Å].

SUBMITTER: Zhou M

PROVIDER: S-EPMC3998427 | biostudies-literature | 2014 Mar

REPOSITORIES: biostudies-literature

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2-[2-(4-Methyl-piperazin-1-yl)eth-yl]iso-indoline-1,3-dione.

Zhou Mi M Shao Ying Y Xia Yong-An YA Liu Xiao-Long XL Sun Xiao-Qiang XQ

Acta crystallographica. Section E, Structure reports online 20140212 Pt 3

In the title compound, C15H19N3O2, the piperazine ring adopts a chair conformation, with its N-C bonds in pseudo-equatorial orientations. The dihedral angle between the C atoms of the piperazine ring and the phthalamide ring system (r.m.s. deviaiton = 0.008 Å) is 89.30 (8)°. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds, generating a three-dimensional network and aromatic π-π inter-actions also occur [centroid-centroid distances = 3.556 (1)-3.716 (1) Å]. ...[more]

PMID: 24764996

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