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Dimethyl 3-acetyl-3-(1,3-benzothia-zol-2-yl)penta-nedioate.

Baryala Y, Salem M, Essassi el M, Reuter H, Izaaryene M - Acta Crystallogr Sect E Struct Rep Online (2008)

Bottom Line: The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar.The maximum deviations from the least-squares planes are 0.015 (2) and 0.020 (2) Å for the methyl C atoms in the methyl acetate substituents and 0.033 (1) Å for the linked C atom of the benzothia-zole substituent.The S, C and N atoms in the thia-zole ring of the benzothia-zole substituent lie -0.037 (2), 0.046 (2) and -0.028 (2) Å, respectively, from the mean plane defined by the benzene ring atoms.

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ABSTRACT
The title compound, C(16)H(17)NO(5)S, was one of two condensation products from the reaction of 1-(1,3-benzothia-zol-2-yl)propan-2-one with methyl chloro-acetate. The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar. The maximum deviations from the least-squares planes are 0.015 (2) and 0.020 (2) Å for the methyl C atoms in the methyl acetate substituents and 0.033 (1) Å for the linked C atom of the benzothia-zole substituent. The S, C and N atoms in the thia-zole ring of the benzothia-zole substituent lie -0.037 (2), 0.046 (2) and -0.028 (2) Å, respectively, from the mean plane defined by the benzene ring atoms.

No MeSH data available.


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The formation of the title compound.
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Fap2: The formation of the title compound.


Dimethyl 3-acetyl-3-(1,3-benzothia-zol-2-yl)penta-nedioate.

Baryala Y, Salem M, Essassi el M, Reuter H, Izaaryene M - Acta Crystallogr Sect E Struct Rep Online (2008)

The formation of the title compound.
© Copyright Policy - open-access
Related In: Results  -  Collection

License
Show All Figures
getmorefigures.php?uid=PMC2959939&req=5

Fap2: The formation of the title compound.
Bottom Line: The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar.The maximum deviations from the least-squares planes are 0.015 (2) and 0.020 (2) Å for the methyl C atoms in the methyl acetate substituents and 0.033 (1) Å for the linked C atom of the benzothia-zole substituent.The S, C and N atoms in the thia-zole ring of the benzothia-zole substituent lie -0.037 (2), 0.046 (2) and -0.028 (2) Å, respectively, from the mean plane defined by the benzene ring atoms.

View Article: PubMed Central - HTML - PubMed

ABSTRACT
The title compound, C(16)H(17)NO(5)S, was one of two condensation products from the reaction of 1-(1,3-benzothia-zol-2-yl)propan-2-one with methyl chloro-acetate. The non-H atoms in each of the four substituent groups on the central quaternary C atom are virtually coplanar. The maximum deviations from the least-squares planes are 0.015 (2) and 0.020 (2) Å for the methyl C atoms in the methyl acetate substituents and 0.033 (1) Å for the linked C atom of the benzothia-zole substituent. The S, C and N atoms in the thia-zole ring of the benzothia-zole substituent lie -0.037 (2), 0.046 (2) and -0.028 (2) Å, respectively, from the mean plane defined by the benzene ring atoms.

No MeSH data available.


Related in: MedlinePlus