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https://doi.org/10.1039/c2nj20929b
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Cite Journal: New Journal of Chemistry |  Publication Date: Jan 1, 2012 |
 Citations: 13 |
Affiliation: Pondicherry University, Presidency University
A new methodology has been proposed to reduce the molecular dinitrogen to ammonia in [WF(PH2(CH2)2PH2)N2] (1) and tested for thermodynamic feasibility by DFT calculations in three different solvents. The calculated barriers for 1 revealed that N2 can be reduced by H2 in organic solvents.
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