1-[2-(2,6-Diisopropylanilino)-1-naphthyl]isoquinoline

RH Howard, N Theobald, M Bochmann, JA Wright

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Abstract

The molecule of the title compound, C31H30N2, contains a single intramolecular hydrogen bond, in contrast with the related N-methyl compound which exists as hydrogen-bonded dimers in the solid state [Cortright, Huffman, Yoder, Coalter and Johnston (2004). Organometallics, 23, 2238-2250]. Application of the density functional theory programs CASTEP and DMol3 allows accurate assignment of the location of the H atoms in the structure. Formula: C31H30N2
Original languageEnglish
Pages (from-to)o310-o312
JournalActa Crystallographica Section C
Volume66
Issue number6
DOIs
Publication statusPublished - 2010

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