✦ LIBER ✦

Theoretical investigations of the H···π and X (X = F, Cl, Br, I)···π complexes between hypohalous acids and benzene

✍ Scribed by Qiang Zhao; Dacheng Feng; Youmin Sun; Jingcheng Hao; Zhengting Cai

Book ID: 106240450
Publisher: Springer-Verlag
Year: 2010
Tongue: English
Weight: 163 KB
Volume: 17
Category: Article
ISSN: 1610-2940
DOI: 10.1007/s00894-010-0906-2

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Influence of the Li⋅⋅⋅π Interaction on t

Influence of the Li⋅⋅⋅π Interaction on the H/X⋅⋅⋅π Interactions in HOLi⋅⋅⋅C 6 H 6 ⋅⋅⋅HOX/XOH (X=F, Cl, Br, I) Complexes

✍ Zeng, Yanli; Wu, Wenjie; Li, Xiaoyan; Zheng, Shijun; Meng, Lingpeng 📂 Article 📅 2013 🏛 John Wiley and Sons 🌐 English ⚖ 778 KB

Theoretical investigation of the convent

Theoretical investigation of the conventional CX1X2− (X1, X2 = H, F, Cl, Br, and I) compounds

✍ Liang Junxi; Wang Yanbin; Zhang Qiang; Geng Zhiyuan; Li Guihua 📂 Article 📅 2012 🏛 Elsevier 🌐 English ⚖ 423 KB

Can the positive aromatic ring be as π-e

Can the positive aromatic ring be as π-electron donor in π-halogen bond? A MP2 theoretical investigation on the unusual π-halogen bond interaction between three-membered ring( left( {hbox{BNN}} ight)_3^{+} )and X1X2 (X1, X2 = F, Cl, Br)

✍ Hai-tao Qi; Fu-de Ren; Jing-lin Zhang; Jing-yu Wang 📂 Article 📅 2010 🏛 Springer-Verlag 🌐 English ⚖ 320 KB

The competition of C-X⋯O=P halogen bond

The competition of C-X⋯O=P halogen bond and π-hole⋯O=P bond between halopentafluorobenzenes C6F5X (X=F, Cl, Br, I) and triethylphosphine oxide

✍ Zhao, Xiao Ran; Wang, Hui; Jin, Wei Jun 📂 Article 📅 2013 🏛 Springer-Verlag 🌐 English ⚖ 566 KB

Molecular orbital calculations of the su

Molecular orbital calculations of the substituent effect on intermolecular CH/π interaction in C2H3X–C6H6 complexes (X=H, F, Cl, Br, and OH)

✍ Osamu Takahashi; Yuji Kohno; Ko Saito 📂 Article 📅 2003 🏛 Elsevier Science 🌐 English ⚖ 234 KB

The effect of a substituent group in dimeric complexes of benzene with ethylene and its four derivatives on the intermolecular CH/p interaction was studied theoretically. The hydrogen-bonding nature of the CH/p interaction is confirmed by the bond critical point analysis within the atoms-in-molecule

Reactivity of the C−X (X = F, Cl, Br, an

Reactivity of the C−X (X = F, Cl, Br, and I) Bond Activation in CX 4 by an Iridium(I) Complex from a Theoretical Viewpoint

✍ Su, Ming-Der; Chu, San-Yan 📂 Article 📅 1999 🏛 American Chemical Society 🌐 English ⚖ 268 KB