Synthesis and Molecular Structure Analysis of 4-(bis(2-chloroethyl)amino)-3-nitro-2H-chromen-2-one by Single crystal XRD Method

Authors

  • Nirav Tatamiya  Zydus Cadila, Ahemdabad, Gujarat, India
  • Jayesh S. Babariya  Shree H.N.Shukla college of science, Rajkot, Gujarat, India
  • Yogesh T. Naliapara  Department of Chemistry, Saurashtra University, Rajkot, Gujarat, India
  • D. M. Purohit  Shree M&N Virani Science College, Rajkot, Gujarat, India

Keywords:

3-Nitro-4-Chloro Coumarine, Hydrogen Bonds

Abstract

A novel 3-nitro and 4-N-mustard functionalized coumarine has been synthesized using 4-chloro, 3-nitro coumarine and Diethanol amine using Isopropyl alcohol as solvent, resultant intermediate undergoes chlorination with Thionyl chloride and DMF as solvent is described. The synthesized compound characterized by spectroscopic techniques and finally confirmed by X-ray diffraction studies. The molecule crystallizes in the monoclinic crystal class in the space group P21/c with cell parameters a = 7.473(1)Aob =   8.169 (1)Ao ,c =  13.957(2)Ao ,a =  87.942(5)Ao ,b =  86.073(5)Ao ,g =  65.040(5)Ao and Z = 4. The Coumarine ring adopts flattened conformation.

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International Journal of Scientific Research in Science, Engineering and Technology

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Published

2017-10-31

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Volume 3, Issue 6, September-October-2017

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Research Articles

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[1]
Nirav Tatamiya, Jayesh S. Babariya, Yogesh T. Naliapara, D. M. Purohit, " Synthesis and Molecular Structure Analysis of 4-(bis(2-chloroethyl)amino)-3-nitro-2H-chromen-2-one by Single crystal XRD Method, International Journal of Scientific Research in Science, Engineering and Technology(IJSRSET), Print ISSN : 2395-1990, Online ISSN : 2394-4099, Volume 3, Issue 6, pp.110-113, September-October-2017.