休克尔分子轨道法处理萘的π键键级的释疑
Elucidation on the Treatment of π Bond Orders of Naphthalene with Hückel Molecular Orbital Method
休克尔分子轨道法处理萘的π键键级的释疑 |
| 魏东辉, 牟方菁, 汪兴华 |
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Elucidation on the Treatment of π Bond Orders of Naphthalene with Hückel Molecular Orbital Method |
| Donghui Wei, Fangjing Mu, Xinghua Wang |
| 图1 (a) 萘的结构式和碳原子编号；(b) HMO法计算的π键键级；(c) 实验测定的键长数值(单位pm)；(d) HF/3-21G级别下计算的π键键级 |
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