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(2S,3S)-3-(4-Chloro-phen-yl)-8-methyl-tropane-2-carboxylic acid.

ABSTRACT: In the title compound, C(15)H(18)ClNO(2), the inter-nal torsion angles of the tropane ring are comparable to those of tropane rings in the crystal structures reported for cocaine and its derivatives. There is an intra-molecular hydrogen bond between the N atom in the tropane ring and the O atom of the carboxyl group. The crystal structure is further stabilized by many weak C-H?O inter-actions between the mol-ecules in the ab plane, forming a two-dimensional supra-molecular network.

SUBMITTER: Chen ZP

PROVIDER: S-EPMC2960499 | biostudies-other | 2008

REPOSITORIES: biostudies-other

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(2S,3S)-3-(4-Chloro-phen-yl)-8-methyl-tropane-2-carboxylic acid.

Chen Zheng-Ping ZP Wang Song-Pei SP Li Xiao-Min XM Tang Jie J Lin Jian-Guo JG

Acta crystallographica. Section E, Structure reports online 20080809 Pt 9

In the title compound, C(15)H(18)ClNO(2), the inter-nal torsion angles of the tropane ring are comparable to those of tropane rings in the crystal structures reported for cocaine and its derivatives. There is an intra-molecular hydrogen bond between the N atom in the tropane ring and the O atom of the carboxyl group. The crystal structure is further stabilized by many weak C-H⋯O inter-actions between the mol-ecules in the ab plane, forming a two-dimensional supra-molecular network. ...[more]

PMID: 21201715

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