ロード中...
Theoretical description of halogen bonding – an insight based on the natural orbitals for chemical valence combined with the extended-transition-state method (ETS-NOCV)
In the present study we have characterized the halogen bonding in selected molecules H(3)N–ICF(3) (1-NH (3)), (PH(3))(2)C–ICF(3) (1-CPH (3)), C(3)H(7)Br–(IN(2)H(2)C(3))(2)C(6)H(4) (2-Br), H(2)–(IN(2)H(2)C(3))(2)C(6)H(4) (2-H (2) ) and Cl–(IC(6)F(5))(2)C(7)H(10)N(2)O(5) (3-Cl), containing from one ha...
保存先:
| 主要な著者: | , |
|---|---|
| フォーマット: | Artigo |
| 言語: | Inglês |
| 出版事項: |
Springer Berlin Heidelberg
2012
|
| 主題: | |
| オンライン･アクセス: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3825488/ https://ncbi.nlm.nih.gov/pubmed/22669533 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1007/s00894-012-1474-4 |
| タグ: |
タグ追加
タグなし, このレコードへの初めてのタグを付けませんか!
|