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Browsing by Subject Molecular calculations
Showing results 1 to 5 of 5
Issue Date | Title | Author(s) |
2006 | Aromaticity-driven rupture of CN triple and CC double bonds: Mechanism of the reaction between Cp2Ti(C4H4) and RCN | Suresh, C H; Koga, N |
2011 | Bond dissociation energies of ligands in square planar Pd(II) and Pt(II) complexes: An assessment using trans influence | Sajith, P K; Suresh, C H |
2007 | Interplay of dual reactivity in the reaction of pentafulvenes with 1,2,4-triazoline-3,5-diones: Experimental and theoretical investigations | Anas, S; Syam Krishnan, K; Sajisha, V S; Anju, K S; Radhakrishnan, K V; Suresh, E; Suresh, C H |
2011 | Mechanisms of reductive eliminations in square planar pd(ii) complexes: Nature of eliminated bonds and role of trans influence | Sajith, P K; Suresh, C H |
2010 | Quantification of mutual trans influence of ligands in Pd(II) complexes: a combined approach using isodesmic reactions and AIM analysis | Sajith, P K; Suresh, C H |