Iterative Arylation of Amino Acids and Aliphatic Amines via δ‐C(sp3)−H Activation: Experimental and Computational Exploration

Iterative Arylation of Amino Acids and Aliphatic Amines via δ‐C(sp3)−H Activation: Experimental and Computational Exploration

This dataset contains the geometries of all optimized structures (in .xyz format with their associated energy in Hartrees) accompanying the paper "Iterative Arylation of Amino Acids and Aliphatic Amines via δ‐C(sp3)−H Activation: Experimental and Computational Exploration" published in Ang...

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Hauptverfasser: Guin, Srimanta, Dolui, Pravas, Zhang, Xinglong, Paul, Satyadip, Singh, Vikas Kumar, Pradhan, Sukumar, Chandrashekar, Hediyala B., Anjana, S. S., Paton, Robert S., Maiti, Debabrata
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creator Guin, Srimanta
Dolui, Pravas
Zhang, Xinglong
Paul, Satyadip
Singh, Vikas Kumar
Pradhan, Sukumar
Chandrashekar, Hediyala B.
Anjana, S. S.
Paton, Robert S.
Maiti, Debabrata
description This dataset contains the geometries of all optimized structures (in .xyz format with their associated energy in Hartrees) accompanying the paper "Iterative Arylation of Amino Acids and Aliphatic Amines via δ‐C(sp3)−H Activation: Experimental and Computational Exploration" published in Angew. Chem. Int. Ed.. doi:10.1002/anie.201900479 on 28 Feb 2019.
doi_str_mv 10.5281/zenodo.2611813
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identifier DOI: 10.5281/zenodo.2611813
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title Iterative Arylation of Amino Acids and Aliphatic Amines via δ‐C(sp3)−H Activation: Experimental and Computational Exploration
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