Crystal Structure Theory and Applications

Volume 1, Issue 3 (December 2012)

ISSN Print: 2169-2491   ISSN Online: 2169-2505

Google-based Impact Factor: 1.33  Citations  

Crystal and Molecular Structure of 2-Amino-3-Ethyl Carboxamido-4-Metyl-5-Carboxy Ethyl Thiophene

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DOI: 10.4236/csta.2012.13017    3,271 Downloads   6,321 Views  

ABSTRACT

The crystal and molecular structure of 2-Amino-3-ethyl carboxamido-4-methyl-5-carboxy ethyl thiophene (C11H16N2O3S) has been investigated from single crystal X-ray diffraction data. The primary focus is to investigate the molecular geometry of this compound in the solid state along with the associated inter and intra-molecular hydrogen bonding and related weak interactions present in this molecule. This compound crystallizes in the monoclinic space group P21/c with cell parameters, a = 8.1344(3) , b = 13.7392(4) , c = 11.4704(4) , β = 100.769(2), V = 1259.36 (7) 3, D = 1.352 g·cm–3, Z = 4. The molecular geometry is stabilized by intra-molecular N-H…O=C and C-H…O interactions along with intramolecular C-H…N and C-H…O interactions which contribute towards the stability of the crystal packing.

Cite this paper

D. Dey, V. Prakash,  . Vasu, J. Saravanan and D. Chopra, "Crystal and Molecular Structure of 2-Amino-3-Ethyl Carboxamido-4-Metyl-5-Carboxy Ethyl Thiophene," Crystal Structure Theory and Applications, Vol. 1 No. 3, 2012, pp. 92-96. doi: 10.4236/csta.2012.13017.

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