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 ◽  
Vol 6 (78) ◽  
pp. 74135-74154 ◽  
Author(s):  
Jaya Pandey ◽  
Preeti Prajapati ◽  
Manishkumar R. Shimpi ◽  
Poonam Tandon ◽  
Sitaram P. Velaga ◽  
...  
Keyword(s):  
Molecular Structure ◽  
Crystal Structure ◽  
Hydrogen Bonding ◽  
Quantum Chemical ◽  
Chemical Activity ◽  
Chemical Approach ◽  
Quantum Chemical Approach

Nitrofurantoin (NTF) as an API and l-proline (LP) as a co-former being used as components to form a model of cocrystal NTF-LP to predict its crystal structure.

Molecular structure and hydrogen bond interactions of a paracetamol–4,4′-bipyridine cocrystal studied using a vibrational spectroscopic and quantum chemical approach

CrystEngComm ◽  
2018 ◽  
Vol 20 (2) ◽  
pp. 213-222 ◽  
Author(s):  
Karnica Srivastava ◽  
Eram Khan ◽  
Manishkumar R. Shimpi ◽  
Poonam Tandon ◽  
Kirti Sinha ◽  
...  
Keyword(s):  
Molecular Structure ◽  
Hydrogen Bond ◽  
Quantum Chemical ◽  
Hydrogen Bond Interactions ◽  
Chemical Approach ◽  
Quantum Chemical Approach

Paracetamol–4,4′-bipyridine cocrystal studied using vibrational spectroscopic and quantum chemical approach.

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