Asymmetric Organocatalytic Nucleophilic Addition to B(sp2) for Direct Construction of Stereogenic B(sp3) Center

The folder /DFT_optimized_structures/ contains the DFT-optimized geometries (in .xyz format together with the gas-phase energy, E) accompanying the paper

"Asymmetric Organocatalytic Nucleophilic Addition to B(sp2) for Direct Construction of Stereogenic B(sp3) Center"

Where conformers occur, they are always named from the lowest Gibbs energy to the highest in ascending order from c1 (sometimes omitted), c2, c3, .., etc.

/DFT_optimized_structures/ 文件夹内收录了配合论文《不对称有机催化亲核加成至B(sp²)中心以直接构建手性B(sp³)中心》所使用的经密度泛函理论（DFT）优化的几何结构，所有文件均采用.xyz格式，并附带气相能量E。
若存在构象体，其命名将始终按照吉布斯自由能由低到高的升序规则，依次编号为c1（有时可省略）、c2、c3……以此类推。