Dr. Manishkumar Shimpi

Dr. Manishkumar Shimpi

Research Topic: Ionic liquids

Contact: manishkumar.shimpi(@)mmk.su.se

 

 

 

 

Research interests
  • Crystal engineering and pharmaceutical cocrystal chemistry
  • Crystal and particle engineering using ionic liquids
  • Processing of pharmaceutical materials
  • Design and synthesis of halogen free ionic liquids for various applications.
  • Structures and interactions of ionic liquids
Publications
  1. Pedireddi, V. R.; Shimpi M. R.; Yakhami, J.V. , Room-Temperature Ionic Liquids: For a Difference in the Supramolecular Synthesis, Macromol. Symp. 2006, 241, 83–87.
  2. Samipillai, M.; Shimpi, M. R.; Pedireddi, V. R.  Novel Supramolecular Assemblies of Coordination Polymers of Zn(II) and Bis (4-nitrophenyl) phosphoric Acid with Some Aza-Donor Compounds. Cryst. Growth Des., 2007, 7, 1791–1796.
  3. Shimpi, M. R.; Nanappan, S.; Pedireddi, V. R. Supramolecular Architecture in Some 4-Halophenylboronic Acid, Cryst. Growth Des., 2007, 7, 1958–1963.
  4. Nagarajan. V.; Pedireddi, V. R.; Shimpi, M. R.* Hydrated and anhydrous molecular complexes of benzenepentacarboxylic acid and 4,4’-bipyridine.
    J. Mol. Struct., 2013, 1050, 216–225.
  5. Shimpi, M. R.; Scott, S. L.; Bonström, D., Velaga, S. P. New cocrystals of ezetimibe with L-proline and imidazole. CrystEngComm., 2014, 16, 8984–8993.
  6. Kong, N.; Shimpi, M. R.; Park, J. H.; Ramström, O.; Mingdi, Y. Carbohydrate conjugation through microwave-assisted functionalization of single-walled carbonnanotubes using perfluorophenylazides. Carbohydrate Research, 2015, 405, 33–38.
  7. Srivastava, K., Shimpi, M. R., Srivastava, A., Tandon, P., Sinha, K.; Velaga, S. Vibrational analysis and chemical activity of paracetamol-oxalic acid cocrystal based on monomer and dimercalculations: DFT and AIM approach.
    RSC Advances, 2016, 12, 10024–10037.
  8. Shimpi, M. R.*, Nandy Biswas, S., Sarkar, S.; Pedireddi, V. R. Synthesis and Structural Evaluation of Five Coordination Complexes of Benzenepentacarboxylic Acid with Aza-donor Ligands. J. Mol. Struct.,2016, 1114, 38–47.
  9. Pandey J., Srivastava, A., Shimpi, M. R., Tandon, P., Sinha, K.; Velaga, S. P.Combined Spectroscopic and Quantum Chemical Studies of Ezetimibe. J. Mol. Struct., 2016, 1125, 193-203.
  10. Golets,M.; Shimpi, M.R.; Wang, Y.-L.; Antzutkin, O. N.; Glavatskih S; Laaksonen A. Understanding Thermal Decomposition Mechanism of a Halogen-Free Chelated Orthoborate-Based Ionic Liquid: A Combined Computational and Experimental Study. Phys. Chem. Chem. Phys., 2016, 18, 22458-22466.
  11. Pandey, J.; Prajapati, P.; Shimpi, M. R.; Tandon, P.; Velaga, S. P.; Srivastava, A.; Sinha, K. Studies of molecular structure, hydrogen bonding and chemical activity of a nitrofurantoin-L-proline cocrystal: a combined spectroscopic and quantum chemical approach. RSC Advances, 2016, 6, 74135-74154.
  12. Wang, Y.-L.; Kloo L.; Shimpi M. R.; Antzutkin O. N; Sarman S.; Laaksonen A.; Sergei, G. Atomistic Insight into Tetraalkylphosphonium Bis(oxalato)borate Ionic Liquid/Water Mixtures. 2. Volumetric and Dynamic Properties. J. Phys. Chem. B, 2016, 120, 7446-55.
  13. Ahmed, H.; Shimpi, M. R.; Velaga, S. P. Relationship between mechanical properties and crystal structure in cocrystals and salt of paracetamol. DrugDevlop. Industrial Pharmacy, 2017, 43, 89-97.
  14. Shimpi M. R.; Velaga, S.P.; Shah F. U.; Antzutkin O. N. Pharmaceutical crystal engineering using ionic liquid anion-solute interactions.  Cryst. Growth Des., 2017, 17, 1729-1734.
  15. Srivastava, K.; Khan, E; Shimpi, M. R.; Tandon, P.; Sinha, K.; Velaga, S.P. Molecular structure and hydrogen bond interactions of Paracetamol-4,4’–bipyridine cocrystal studied using vibrational spectroscopic and quantum chemical approach. CrystEngComm., 2017, 20, 213-222.
  16. Shimpi, M. R.; *Giri, L.; Pedireddi, V. R. Preparation and structure analysis of three new copper complexes of mellitic acid with 4,4’-bipyridine and 1,3-bis(4-pyridyl) propane.  ChemistrySelect, 2018, 3, 855-858.
  17. Shimpi, M.R.; Alhayali, A.; Cavanagh, K. L.; Rodríguez-Hornedo, N.; Velaga, S. P. Tadalafil-malonic acid cocrystal: Physicochemical characterization, pH-solubility and supersaturation studies. Cryst. Growth Des., 2018, 18, 4378-4387.
  18. Varma P.; Srivastava, A; Shukla, A.; Tandon, P. *; Shimpi, M. R.* Vibrational spectra, hydrogen bonding interactions and chemical reactivity analysis of nicotinamide–citric acid cocrystals by an experimental and theoretical approach.  New J. Chemistry, 2019, 43, 15956-15967.
  19. Srivastava, K; Shukla, A.; Karthick, T. Velaga, S. P.; Tandon, P.*; Sinha, K.; Shimpi, M. R.* Molecular structure, spectroscopic signature and reactivity analyses of paracetamol hydrochloride monohydrate salt using density functional theory calculations. CrystEngComm, 2019, 21, 857-865.
  20. Shimpi, M. R.; Rohlmann, P.; Glavatskih, S. Antzutkin O. N; Trihexyl(tetradecyl)phosphonium-Bis(oxalato)borate Ionic Liquid – Revisited. Phys. Chem. Chem. Phys., 2021, 23, 6190-6203.
  21. Rohlmann, P.; Watanabe, S.; Shimpi, M. R.; Leckner, J.; Rutland, M. W.; Harper, J. B.; Glavatskih, S. Boundary lubricity of phosphonium bisoxalatoborate ionic liquids.  Tribol. Int. 2021, 161, 107075.
  22. Varma P.; Srivastava, A; Srivastava, K; Shukla, A.; Tandon, P.; Shimpi, M. R., Molecular structure, spectral investigations, hydrogen bonding interactions and reactivity-property relationship of caffeine-citric acid cocrystal by experimental and DFT approach. Front. Chem. 2021, doi: 10.3389/fchem.2021.708538