Limits...
Crystal structure of (R)-N-benzyl-1-phenylethanaminium (R)-4-chloro-mandelate.

Peng Y, Rohani S, Boyle PD, He Q - Acta Crystallogr Sect E Struct Rep Online (2014)

Bottom Line: The absolute configuration of the title mol-ecular salt, C15H18N(+)·C8H6ClO3 (-), has been confirmed by resonant scattering.In the crystal, the (R)-4-chloro-mandelate anions are linked via O-H⋯O hydrogen bonds and bridged by N-H⋯O hydrogen bonds involving the cations, forming chains along [010].The structure was refined as a two-component inversion twin giving a Flack parameter of 0.05 (4).

View Article: PubMed Central - HTML - PubMed

Affiliation: School of Chemical Engineering, East China University of Science and Technology, Shanghai, 200237, People's Republic of China.

ABSTRACT
The absolute configuration of the title mol-ecular salt, C15H18N(+)·C8H6ClO3 (-), has been confirmed by resonant scattering. In the (R)-N-benzyl-1-phenyl-ethyl-ammonium cation, the phenyl rings are inclined to one another by 44.65 (7)°. In the crystal, the (R)-4-chloro-mandelate anions are linked via O-H⋯O hydrogen bonds and bridged by N-H⋯O hydrogen bonds involving the cations, forming chains along [010]. There are C-H⋯O hydrogen bonds present within the chains, which are linked via C-H⋯π inter-actions and a short Cl⋯Cl inter-action [3.193 (1) Å] forming a three-dimensional framework. The structure was refined as a two-component inversion twin giving a Flack parameter of 0.05 (4).

No MeSH data available.


Related in: MedlinePlus

A view of the molecular structure of the title salt, with atom labelling. Displacement ellipsoids are drawn at the 50% probability level.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
getmorefigures.php?uid=PMC4257388&req=5

Fap1: A view of the molecular structure of the title salt, with atom labelling. Displacement ellipsoids are drawn at the 50% probability level.


Crystal structure of (R)-N-benzyl-1-phenylethanaminium (R)-4-chloro-mandelate.

Peng Y, Rohani S, Boyle PD, He Q - Acta Crystallogr Sect E Struct Rep Online (2014)

A view of the molecular structure of the title salt, with atom labelling. Displacement ellipsoids are drawn at the 50% probability level.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC4257388&req=5

Fap1: A view of the molecular structure of the title salt, with atom labelling. Displacement ellipsoids are drawn at the 50% probability level.
Bottom Line: The absolute configuration of the title mol-ecular salt, C15H18N(+)·C8H6ClO3 (-), has been confirmed by resonant scattering.In the crystal, the (R)-4-chloro-mandelate anions are linked via O-H⋯O hydrogen bonds and bridged by N-H⋯O hydrogen bonds involving the cations, forming chains along [010].The structure was refined as a two-component inversion twin giving a Flack parameter of 0.05 (4).

View Article: PubMed Central - HTML - PubMed

Affiliation: School of Chemical Engineering, East China University of Science and Technology, Shanghai, 200237, People's Republic of China.

ABSTRACT
The absolute configuration of the title mol-ecular salt, C15H18N(+)·C8H6ClO3 (-), has been confirmed by resonant scattering. In the (R)-N-benzyl-1-phenyl-ethyl-ammonium cation, the phenyl rings are inclined to one another by 44.65 (7)°. In the crystal, the (R)-4-chloro-mandelate anions are linked via O-H⋯O hydrogen bonds and bridged by N-H⋯O hydrogen bonds involving the cations, forming chains along [010]. There are C-H⋯O hydrogen bonds present within the chains, which are linked via C-H⋯π inter-actions and a short Cl⋯Cl inter-action [3.193 (1) Å] forming a three-dimensional framework. The structure was refined as a two-component inversion twin giving a Flack parameter of 0.05 (4).

No MeSH data available.


Related in: MedlinePlus