N-H.N hydrogen bonding in 4,6-diphenyl-2-pyrimidinylamine isolated from the plant Justicia secunda (Acanthaceae).

Autor: Gallagher JF; School of Chemical Sciences, Dublin City University, Dublin 9, Ireland. john.gallagher@dcu.ie, Goswami S, Chatterjee B, Jana S, Dutta K
Jazyk: angličtina
Zdroj: Acta crystallographica. Section C, Crystal structure communications [Acta Crystallogr C] 2004 Apr; Vol. 60 (Pt 4), pp. o229-31. Date of Electronic Publication: 2004 Mar 11.
DOI: 10.1107/S0108270104002902
Abstrakt: The title compound, C(16)H(13)N(3), isolated from Justicia secunda (Acanthaceae), comprises two molecules (which differ slightly in conformation) in the asymmetric unit of space group P-1. Intermolecular N(amino)-H.N(pyrm) interactions (N(pyrm) is a pyrimidine ring N atom) involve only one of the two donor amino H atoms and pyrimidine N atoms per molecule, forming dimeric units via R(2)(2)(8) rings, with N.N distances of 3.058 (2) and 3.106 (3) A, and N-H.N angles of 172.7 (18) and 175.8 (17) degrees. The dimers are linked by C-H.pi(arene) contacts, with an H.centroid distance of 2.77 A and a C-H.centroid angle of 141 degrees.
Databáze: MEDLINE