When we talk about orbitals in multi-electron atoms, they're actually lower in energy than the corresponding H atom orbitals.
当我们讨论多电子原子的轨道时,它们的能量实际上比对应的氢原子轨道要低。
H atom of phenolic hydroxyl in the ligand was attractive to N atom forming intramolecular hydrogen bond, and a new six-membered ring was formed by the hydrogen bond connection.
配体中酚羟基上的H原子与N原子相吸形成了分子内氢键,并以氢键连接构成了一个新六元环。
Using ab initio method, the minimum energy conformations and netcharge distribution have been studied for H_2CN radical isomers formed by addition ofa H atom (or an electron) to HCN (or HNC) molecule.
用量子化学从头计算法研究了HCN、HNC分子与H原子和电子加成生成的H_2CN自由基异构体的最低总能量构象和净电荷分布。
Using ab initio method, the minimum energy conformations and netcharge distribution have been studied for H_2CN radical isomers formed by addition ofa H atom (or an electron) to HCN (or HNC) molecule.
用量子化学从头计算法研究了HCN、HNC分子与H原子和电子加成生成的H_2CN自由基异构体的最低总能量构象和净电荷分布。
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