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4-[Bis(4-fluoro-phen-yl)meth-yl]-1-[(2E)-3-phenyl-prop-2-en-1-yl]piperazin-1-ium 3-carb-oxy-propano-ate.

Kavitha CN, Yathirajan HS, Narayana B, Gerber T, van Brecht B, Betz R - Acta Crystallogr Sect E Struct Rep Online (2013)

Bottom Line: The piperazine ring adopts a chair conformation.C-H⋯O inter-actions connect these chains into a three-dimensional network.The shortest centroid-centroid distance of 3.7256 (10) Å was found between one of the fluorinated benzene rings and the non-fluorinated phenyl ring in the neighbouring mol-ecule related by a glide plane.

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Affiliation: University of Mysore, Department of Studies in Chemistry, Manasagangotri, Mysore 570 006, India.

ABSTRACT
In the title salt, C(26)H(27)F(2)N(2) (+)·C(4)H(5)O(4) (-), the piperazine N atom bearing the vinylic substituent is protonated. The piperazine ring adopts a chair conformation. In ther crystal, the succinate monoanions are connected via short O-H⋯O hydrogen bonds between the carb-oxy-lic acid and carboxyl-ate groups into undulating chains extending along [001] and the flunarizinium monocations are attached to these chains via N(+)-H⋯O(-) hydrogen bonds. C-H⋯O inter-actions connect these chains into a three-dimensional network. The shortest centroid-centroid distance of 3.7256 (10) Å was found between one of the fluorinated benzene rings and the non-fluorinated phenyl ring in the neighbouring mol-ecule related by a glide plane.

No MeSH data available.


The molecular structure of the title compound, with atom labels and anisotropic displacement ellipsoids drawn at 50% probability level.
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Fap1: The molecular structure of the title compound, with atom labels and anisotropic displacement ellipsoids drawn at 50% probability level.


4-[Bis(4-fluoro-phen-yl)meth-yl]-1-[(2E)-3-phenyl-prop-2-en-1-yl]piperazin-1-ium 3-carb-oxy-propano-ate.

Kavitha CN, Yathirajan HS, Narayana B, Gerber T, van Brecht B, Betz R - Acta Crystallogr Sect E Struct Rep Online (2013)

The molecular structure of the title compound, with atom labels and anisotropic displacement ellipsoids drawn at 50% probability level.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3569791&req=5

Fap1: The molecular structure of the title compound, with atom labels and anisotropic displacement ellipsoids drawn at 50% probability level.
Bottom Line: The piperazine ring adopts a chair conformation.C-H⋯O inter-actions connect these chains into a three-dimensional network.The shortest centroid-centroid distance of 3.7256 (10) Å was found between one of the fluorinated benzene rings and the non-fluorinated phenyl ring in the neighbouring mol-ecule related by a glide plane.

View Article: PubMed Central - HTML - PubMed

Affiliation: University of Mysore, Department of Studies in Chemistry, Manasagangotri, Mysore 570 006, India.

ABSTRACT
In the title salt, C(26)H(27)F(2)N(2) (+)·C(4)H(5)O(4) (-), the piperazine N atom bearing the vinylic substituent is protonated. The piperazine ring adopts a chair conformation. In ther crystal, the succinate monoanions are connected via short O-H⋯O hydrogen bonds between the carb-oxy-lic acid and carboxyl-ate groups into undulating chains extending along [001] and the flunarizinium monocations are attached to these chains via N(+)-H⋯O(-) hydrogen bonds. C-H⋯O inter-actions connect these chains into a three-dimensional network. The shortest centroid-centroid distance of 3.7256 (10) Å was found between one of the fluorinated benzene rings and the non-fluorinated phenyl ring in the neighbouring mol-ecule related by a glide plane.

No MeSH data available.