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2-Bromo-2-methyl-1-[4-(methyl-sulfan-yl)phen-yl]propan-1-one.

Liu F, Ren SY, Yang WJ - Acta Crystallogr Sect E Struct Rep Online (2012)

Bottom Line: In the title compound, C(11)H(13)BrOS, the thio-ether unit and the phenyl ring adopt an essentially planar conformation, with a maximum deviation of 0.063 Å.In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds, extending in zigzag chains along the b axis.A weak intra-molecular C-H⋯Br hydrogen bond is also observed, which forms an S(6) ring motif.

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ABSTRACT
In the title compound, C(11)H(13)BrOS, the thio-ether unit and the phenyl ring adopt an essentially planar conformation, with a maximum deviation of 0.063 Å. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds, extending in zigzag chains along the b axis. A weak intra-molecular C-H⋯Br hydrogen bond is also observed, which forms an S(6) ring motif.

No MeSH data available.


Related in: MedlinePlus

The molecular structure of (I), showing the atom-numbering scheme and displacement ellipsoids drawn at the 50% probability level.
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Fap1: The molecular structure of (I), showing the atom-numbering scheme and displacement ellipsoids drawn at the 50% probability level.


2-Bromo-2-methyl-1-[4-(methyl-sulfan-yl)phen-yl]propan-1-one.

Liu F, Ren SY, Yang WJ - Acta Crystallogr Sect E Struct Rep Online (2012)

The molecular structure of (I), showing the atom-numbering scheme and displacement ellipsoids drawn at the 50% probability level.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC3379344&req=5

Fap1: The molecular structure of (I), showing the atom-numbering scheme and displacement ellipsoids drawn at the 50% probability level.
Bottom Line: In the title compound, C(11)H(13)BrOS, the thio-ether unit and the phenyl ring adopt an essentially planar conformation, with a maximum deviation of 0.063 Å.In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds, extending in zigzag chains along the b axis.A weak intra-molecular C-H⋯Br hydrogen bond is also observed, which forms an S(6) ring motif.

View Article: PubMed Central - HTML - PubMed

ABSTRACT
In the title compound, C(11)H(13)BrOS, the thio-ether unit and the phenyl ring adopt an essentially planar conformation, with a maximum deviation of 0.063 Å. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds, extending in zigzag chains along the b axis. A weak intra-molecular C-H⋯Br hydrogen bond is also observed, which forms an S(6) ring motif.

No MeSH data available.


Related in: MedlinePlus