Unknown

Dataset Information

0

Crystal structure of morpholin-4-ium cinnamate.


ABSTRACT: In the anhydrous salt formed from the reaction of morpholine with cinnamic acid, C4H10NO(+)·C9H7O2 (-), the acid side chain in the trans-cinnamate anion is significantly rotated out of the benzene plane [C-C-C- C torsion angle = 158.54?(17)°]. In the crystal, one of the the aminium H atoms is involved in an asymmetric three-centre cation-anion N-H?(O,O') R 1 (2)(4) hydrogen-bonding inter-action with the two carboxyl-ate O-atom acceptors of the anion. The second aminium-H atom forms an inter-species N-H?Ocarboxyl-ate hydrogen bond. The result of the hydrogen bonding is the formation of a chain structure extending along [100]. Chains are linked by C-H?O inter-actions, forming a supra-molecular layer parallel to (01-1).

SUBMITTER: Smith G 

PROVIDER: S-EPMC4645001 | biostudies-literature | 2015 Nov

REPOSITORIES: biostudies-literature

altmetric image

Publications

Crystal structure of morpholin-4-ium cinnamate.

Smith Graham G  

Acta crystallographica. Section E, Crystallographic communications 20151017 Pt 11


In the anhydrous salt formed from the reaction of morpholine with cinnamic acid, C4H10NO(+)·C9H7O2 (-), the acid side chain in the trans-cinnamate anion is significantly rotated out of the benzene plane [C-C-C- C torsion angle = 158.54 (17)°]. In the crystal, one of the the aminium H atoms is involved in an asymmetric three-centre cation-anion N-H⋯(O,O') R 1 (2)(4) hydrogen-bonding inter-action with the two carboxyl-ate O-atom acceptors of the anion. The second aminium-H atom forms an inter-spec  ...[more]

Similar Datasets

| S-EPMC3274983 | biostudies-literature
| S-EPMC3344043 | biostudies-literature
| S-EPMC3274992 | biostudies-literature
| S-EPMC3254319 | biostudies-literature
| S-EPMC3213463 | biostudies-literature
| S-EPMC4555416 | biostudies-literature
| S-EPMC3152096 | biostudies-literature
| S-EPMC3007199 | biostudies-literature