| Harnessing the Efficacy of 2-Pyridone Ligands for Pd-Catalyzed (β/γ)-C(sp3)–H Activations N Mandal, A Datta The Journal of Organic Chemistry 85 (20), 13228-13238, 2020 | 33 | 2020 |
| Exploring Ultrashort Hydrogen–Hydrogen Nonbonded Contacts in Constrained Molecular Cavities N Mandal, SM Pratik, A Datta The Journal of Physical Chemistry B 121 (4), 825-834, 2017 | 32 | 2017 |
| Gold (I)-catalyzed intramolecular diels–alder reaction: evolution of trappable intermediates via asynchronous transition states N Mandal, A Datta The Journal of Organic Chemistry 83 (18), 11167-11177, 2018 | 23 | 2018 |
| Transition-State-like Planar Structures for Amine Inversion with Ultralong C–C Bonds in Diamino-o-carborane and Diamino-o-dodecahedron N Mandal, AK Pal, P Gain, A Zohaib, A Datta Journal of the American Chemical Society 142 (11), 5331-5337, 2020 | 21 | 2020 |
| Structure and electronic properties of unnatural base pairs: The role of dispersion interactions S Jahiruddin, N Mandal, A Datta ChemPhysChem 19 (1), 67-74, 2018 | 20 | 2018 |
| Dynamical effects along the bifurcation pathway control semibullvalene formation in deazetization reactions N Mandal, A Datta The Journal of Physical Chemistry B 122 (3), 1239-1244, 2018 | 18 | 2018 |
| Hierarchical noncovalent interactions between molecules stabilize multicomponent cocrystals S Mandal, TK Mukhopadhyay, N Mandal, A Datta Crystal Growth & Design 19 (8), 4802-4809, 2019 | 16 | 2019 |
| Molecular designs for expanding the limits of ultralong C–C bonds and ultrashort H⋯ H non-bonded contacts N Mandal, A Datta Chemical Communications 56 (98), 15377-15386, 2020 | 14 | 2020 |
| Enhancement in electrical conductivity of a porous indium based metal–organic framework upon I 2 uptake: combined experimental and theoretical investigations P Mani, N Mandal, M Roopesh, H Gopalakrishnan, A Datta, S Mandal Journal of Materials Chemistry C 8 (14), 4836-4842, 2020 | 14 | 2020 |
| On bonding in bis (dimethylglyoximato) nickel (II) SG Patra, N Mandal, A Datta, D Datta Computational and Theoretical Chemistry 1114, 118-124, 2017 | 13 | 2017 |
| Aromaticity of N‐heterocyclic carbene and its analogues: Magnetically induced ring current perspective SG Patra, N Mandal International Journal of Quantum Chemistry 120 (9), e26152, 2020 | 11 | 2020 |
| Stereoelectronic and dynamical effects dictate nitrogen inversion during valence isomerism in benzene imine N Mandal, A Das, C Hajra, A Datta Chemical Science 13 (3), 704-712, 2022 | 7 | 2022 |
| Harnessing noncovalent interactions for a directed evolution of a six-component molecular crystal S Mandal, AK Pal, N Mandal, TK Mukhopadhyay, A Datta The Journal of Physical Chemistry B 125 (45), 12584-12591, 2021 | 7 | 2021 |
| Computational Insights into Palladium-Catalyzed Site-Selective Anilide and Benzamide-Type [3+ 2] Annulation via Double C–H Bond Activation P Mondal, N Mandal, AK Pal, A Datta The Journal of Organic Chemistry, 2024 | 1 | 2024 |
| Unlocking Enantioselectivity: Synergy of 2-Pyridone and Chiral Amino Acids in Pd-Catalyzed β-C (sp3)–H Transformations N Mandal, P Mondal, S Mandal, A Datta The Journal of Organic Chemistry, 2024 | 1 | 2024 |
| Designing Principles for Ultrashort H∙∙∙H Non-Bonded Contacts and Ultralong C–C Bonds N Mandal, A Datta Electron Density: Concepts, Computation and DFT Applications, 576, 2024 | | 2024 |
| Biomimetic total synthesis of the reported structure of (+)-selaginedorffone B S Kundu, D Jana, N Mandal, A Mondal, R Murmu, NK Roy, A Datta, ... Chemical Science, 2024 | | 2024 |
| Mechanistic Understandings of Gold-Catalyzed C–H Functionalization A Nijamudheen, N Mandal, A Datta Handbook of CH-Functionalization, 1-20, 2022 | | 2022 |
| Dynamical Effects in Molecular Structure for Applications in Homogeneous Catalysis N Mandal Indian Association for the Cultivation of Science, 2022 | | 2022 |
