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Benzyl N-[(Z)-(1-methyl-2-sulfanyl-propyl-idene)amino]-carbamodithio-ate.

Break MK, Mehta S, Tahir MI, Crouse KA, Khoo TJ - Acta Crystallogr Sect E Struct Rep Online (2013)

Bottom Line: The title compound, C(12)H(16)N(2)S(3), was obtained by the condensation reaction of S-benzyl dithio-carbazate and 3-mercaptobutan-2-one.The phenyl ring and thiol (SH) group are approximately perpendicular [S-C-C-C and N-C-C-S torsion angles = 67.8 (3) and 116.9 (2)°, respectively] to the rest of the mol-ecule.In the crystal, mol-ecules are linked by weak S-H⋯S and N-H⋯S hydrogen bonds, π-π inter-actions between the benzene rings [centroid-centroid distance = 3.823 (2) Å] and C-H⋯π inter-actions.

View Article: PubMed Central - HTML - PubMed

Affiliation: School of Pharmacy, University of Nottingham Malaysia Campus, Selangor, Malaysia.

ABSTRACT
The title compound, C(12)H(16)N(2)S(3), was obtained by the condensation reaction of S-benzyl dithio-carbazate and 3-mercaptobutan-2-one. The phenyl ring and thiol (SH) group are approximately perpendicular [S-C-C-C and N-C-C-S torsion angles = 67.8 (3) and 116.9 (2)°, respectively] to the rest of the mol-ecule. In the crystal, mol-ecules are linked by weak S-H⋯S and N-H⋯S hydrogen bonds, π-π inter-actions between the benzene rings [centroid-centroid distance = 3.823 (2) Å] and C-H⋯π inter-actions.

No MeSH data available.


Related in: MedlinePlus

Diagram showing the C—H···π interactions between the molecules of the structure. Distance between the centroid of the benzene ring and the hydrogen atom of the neighbouring molecule is 2.970 Å.
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Fap4: Diagram showing the C—H···π interactions between the molecules of the structure. Distance between the centroid of the benzene ring and the hydrogen atom of the neighbouring molecule is 2.970 Å.


Benzyl N-[(Z)-(1-methyl-2-sulfanyl-propyl-idene)amino]-carbamodithio-ate.

Break MK, Mehta S, Tahir MI, Crouse KA, Khoo TJ - Acta Crystallogr Sect E Struct Rep Online (2013)

Diagram showing the C—H···π interactions between the molecules of the structure. Distance between the centroid of the benzene ring and the hydrogen atom of the neighbouring molecule is 2.970 Å.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3569240&req=5

Fap4: Diagram showing the C—H···π interactions between the molecules of the structure. Distance between the centroid of the benzene ring and the hydrogen atom of the neighbouring molecule is 2.970 Å.
Bottom Line: The title compound, C(12)H(16)N(2)S(3), was obtained by the condensation reaction of S-benzyl dithio-carbazate and 3-mercaptobutan-2-one.The phenyl ring and thiol (SH) group are approximately perpendicular [S-C-C-C and N-C-C-S torsion angles = 67.8 (3) and 116.9 (2)°, respectively] to the rest of the mol-ecule.In the crystal, mol-ecules are linked by weak S-H⋯S and N-H⋯S hydrogen bonds, π-π inter-actions between the benzene rings [centroid-centroid distance = 3.823 (2) Å] and C-H⋯π inter-actions.

View Article: PubMed Central - HTML - PubMed

Affiliation: School of Pharmacy, University of Nottingham Malaysia Campus, Selangor, Malaysia.

ABSTRACT
The title compound, C(12)H(16)N(2)S(3), was obtained by the condensation reaction of S-benzyl dithio-carbazate and 3-mercaptobutan-2-one. The phenyl ring and thiol (SH) group are approximately perpendicular [S-C-C-C and N-C-C-S torsion angles = 67.8 (3) and 116.9 (2)°, respectively] to the rest of the mol-ecule. In the crystal, mol-ecules are linked by weak S-H⋯S and N-H⋯S hydrogen bonds, π-π inter-actions between the benzene rings [centroid-centroid distance = 3.823 (2) Å] and C-H⋯π inter-actions.

No MeSH data available.


Related in: MedlinePlus