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Crystal structure of tert-butyl-N-phenyl-carbonitrilium tetra-chlorido-aluminate.

ABSTRACT: In the title compound, (C11H14N)[AlCl4], the nitrilium (systematic name: 2,2-dimethyl-N-phenyl-propane-nitrilium) ion adopts a slightly distorted linear configuration [C-N C = 178.87?(16) and N C-C = 179.13?(17)°]. In the crystal, while there are no inter-molecular hydrogen bonds, pairs of nitrilium ions are linked through ?-? inter-actions [inter-centroid distance = 3.8091?(13)?Å].

SUBMITTER: van Dijk T

PROVIDER: S-EPMC4257323 | biostudies-literature | 2014 Nov

REPOSITORIES: biostudies-literature

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Crystal structure of tert-butyl-N-phenyl-carbonitrilium tetra-chlorido-aluminate.

van Dijk Tom T Zant Dirk W DW Wolf Robert R Lammertsma Koop K Slootweg J Chris JC

Acta crystallographica. Section E, Structure reports online 20141011 Pt 11

In the title compound, (C11H14N)[AlCl4], the nitrilium (systematic name: 2,2-dimethyl-N-phenyl-propane-nitrilium) ion adopts a slightly distorted linear configuration [C-N C = 178.87 (16) and N C-C = 179.13 (17)°]. In the crystal, while there are no inter-molecular hydrogen bonds, pairs of nitrilium ions are linked through π-π inter-actions [inter-centroid distance = 3.8091 (13) Å]. ...[more]

PMID: 25484737

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