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4-[(2-Chloroethyl)amino]quinolinium chloride monohydrate
In the title salt hydrate, C(11)H(12)ClN(2) (+)·Cl(−)·H(2)O, the quinolinium core is essentially planar (r.m.s. deviation = 0.027 Å) with the chloroethyl side chain being almost orthogonal to the core [C—N—C—C torsion angle = −80.0 (3)°]. In the crystal packing, the water molecule bridges three s...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2971810/ https://www.ncbi.nlm.nih.gov/pubmed/21578845 http://dx.doi.org/10.1107/S160053680904834X |
Sumario: | In the title salt hydrate, C(11)H(12)ClN(2) (+)·Cl(−)·H(2)O, the quinolinium core is essentially planar (r.m.s. deviation = 0.027 Å) with the chloroethyl side chain being almost orthogonal to the core [C—N—C—C torsion angle = −80.0 (3)°]. In the crystal packing, the water molecule bridges three species, forming donor interactions to two chloride anions and accepting a hydrogen bond from the quinolinium H atom. The chloride anion accepts a hydrogen bond from the amine N atom with the result that a two-dimensional supramolecular array is formed in the ac plane. A C—H⋯Cl interaction also occurs. |
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