Access to Unsaturated Bicyclic Lactones by Overriding Conventional C(sp3)–H Site Selectivity
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https://zenodo.org/record/7329958
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资源简介：
This folder /final_xyz/ contains the DFT-optimized geometries (in .xyz format together with the gas-phase energy, E) accompanying the paper
"Access to Unsaturated Bicyclic Lactones by Overriding Conventional C(sp3)-H Site Selectivity"
Where conformers occur, they are always named from the lowest Gibbs energy to the highest in ascending order from c1 (sometimes omitted), c2, c3, ...
创建时间：
2023-01-10
