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Butyl 4-(4-methyl-benzene-sulfonamido)-benzoate.

Mustafa G, Akkurt M, Dağdemir Y, Khan IU - Acta Crystallogr Sect E Struct Rep Online (2012)

Bottom Line: The mol-ecular conformation is stabilized by an intra-molecular C-H⋯O inter-action, which generates an S(6) motif.In the crystal, N-H⋯O and C-H⋯O hydrogen bonds lead to the formation of chains propagating along [010].The -CH(2)CH(2)CH(3) atoms of the butyl group are disordered over two sets of sites, with a refined site-occupancy ratio of 0.536 (16):0.464 (16).

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ABSTRACT
In the title compound, C(18)H(21)NO(4)S, the aromatic rings are almost normal to each other, with a dihedral angle of 89.27 (18)°. The mol-ecular conformation is stabilized by an intra-molecular C-H⋯O inter-action, which generates an S(6) motif. In the crystal, N-H⋯O and C-H⋯O hydrogen bonds lead to the formation of chains propagating along [010]. Neighbouring chains are linked via a C-H⋯π inter-action. The -CH(2)CH(2)CH(3) atoms of the butyl group are disordered over two sets of sites, with a refined site-occupancy ratio of 0.536 (16):0.464 (16).

No MeSH data available.


Related in: MedlinePlus

The molecular structure of the title molecule, with the atom numbering. Displacement ellipsoids are drawn at the 20% probability level. Only the atoms of the major disordered component of the butyl group are shown.
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Fap1: The molecular structure of the title molecule, with the atom numbering. Displacement ellipsoids are drawn at the 20% probability level. Only the atoms of the major disordered component of the butyl group are shown.


Butyl 4-(4-methyl-benzene-sulfonamido)-benzoate.

Mustafa G, Akkurt M, Dağdemir Y, Khan IU - Acta Crystallogr Sect E Struct Rep Online (2012)

The molecular structure of the title molecule, with the atom numbering. Displacement ellipsoids are drawn at the 20% probability level. Only the atoms of the major disordered component of the butyl group are shown.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3344642&req=5

Fap1: The molecular structure of the title molecule, with the atom numbering. Displacement ellipsoids are drawn at the 20% probability level. Only the atoms of the major disordered component of the butyl group are shown.
Bottom Line: The mol-ecular conformation is stabilized by an intra-molecular C-H⋯O inter-action, which generates an S(6) motif.In the crystal, N-H⋯O and C-H⋯O hydrogen bonds lead to the formation of chains propagating along [010].The -CH(2)CH(2)CH(3) atoms of the butyl group are disordered over two sets of sites, with a refined site-occupancy ratio of 0.536 (16):0.464 (16).

View Article: PubMed Central - HTML - PubMed

ABSTRACT
In the title compound, C(18)H(21)NO(4)S, the aromatic rings are almost normal to each other, with a dihedral angle of 89.27 (18)°. The mol-ecular conformation is stabilized by an intra-molecular C-H⋯O inter-action, which generates an S(6) motif. In the crystal, N-H⋯O and C-H⋯O hydrogen bonds lead to the formation of chains propagating along [010]. Neighbouring chains are linked via a C-H⋯π inter-action. The -CH(2)CH(2)CH(3) atoms of the butyl group are disordered over two sets of sites, with a refined site-occupancy ratio of 0.536 (16):0.464 (16).

No MeSH data available.


Related in: MedlinePlus