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Crystal structure of 3-bromo-methyl-2-chloro-6-(di-bromo-meth-yl)quinoline.

ABSTRACT: In the title compound, C11H7Br3ClN, the quinoline ring system is approximately planar (r.m.s. = 0.011?Å). In the crystal, mol-ecules are linked by C-H?Br inter-actions forming chains along [10-1]. The chains are linked by C-H?? and ?-? inter-actions involving inversion-related pyridine rings [inter-centroid distance = 3.608?(4)?Å], forming sheets parallel to (10-1). Within the sheets, there are two significant short inter-actions involving a Br?Cl contact of 3.4904?(18)?Å and a Br?N contact of 3.187?(6)?Å, both of which are significantly shorter than the sum of their van der Waals radii.

SUBMITTER: Gayathri K

PROVIDER: S-EPMC4420095 | biostudies-literature | 2015 May

REPOSITORIES: biostudies-literature

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Crystal structure of 3-bromo-methyl-2-chloro-6-(di-bromo-meth-yl)quinoline.

Gayathri Kasirajan K Mohan Palathurai S PS Howard Judith A K JA Sparkes Hazel A HA

Acta crystallographica. Section E, Crystallographic communications 20150430 Pt 5

In the title compound, C11H7Br3ClN, the quinoline ring system is approximately planar (r.m.s. = 0.011 Å). In the crystal, mol-ecules are linked by C-H⋯Br inter-actions forming chains along [10-1]. The chains are linked by C-H⋯π and π-π inter-actions involving inversion-related pyridine rings [inter-centroid distance = 3.608 (4) Å], forming sheets parallel to (10-1). Within the sheets, there are two significant short inter-actions involving a Br⋯Cl contact of 3.4904 (18) Å and a Br⋯N contact of 3 ...[more]

PMID: 25995945

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