✦ LIBER ✦

Identity SN2 Reactions X−+CH3X→XCH3+X− (X=F, Cl, Br, and I) in Vacuum and in Aqueous Solution: A Valence Bond Study

✍ Scribed by Lingchun Song; Wei Wu; Philippe C. Hiberty; Sason Shaik

Publisher: John Wiley and Sons
Year: 2006
Tongue: English
Weight: 136 KB
Volume: 12
Category: Article
ISSN: 0947-6539
DOI: 10.1002/chem.200600372

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Density Functional Study of the Complexa

Density Functional Study of the Complexation Reaction of Sn(CH3)3X (X = F, Cl, Br and I) with Halide Anions

✍ Frank De Proft; Ricardo Vivas-Reyes; Monique Biesemans; Rudolph Willem; Jan M. L 📂 Article 📅 2003 🏛 John Wiley and Sons 🌐 English ⚖ 151 KB

Local Structures around Pb(II) and Sn(II

Local Structures around Pb(II) and Sn(II) in CH3NH3PbX3 (X = Cl, Br, I) and CH3NH3SnX3 (X = Br, I) Studied by Pb LIII-Edge and Sn K-Edge EXAFS

✍ Ishida, H. ;Maeda, H. ;Hirano, A. ;Kubozono, Y. ;Furukawa, Y. 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 239 KB

Structure and Bonding in Silver Halides.

Structure and Bonding in Silver Halides. A Quantum Chemical Study of the Monomers: Ag2X, AgX, AgX2, and AgX3 (X: F, Cl, Br, I).

✍ Hans-Christian Mueller-Roesing; Axel Schulz; Magdolna Hargittai 📂 Article 📅 2005 🏛 John Wiley and Sons ⚖ 8 KB 👁 2 views

Study of the Nature of Improper Blue-Shi

Study of the Nature of Improper Blue-Shifting Hydrogen Bonding and Standard Hydrogen Bonding in the X3CH⋅⋅⋅OH2 and XH⋅⋅⋅OH2 Complexes (X=F, Cl, Br, I): A Correlated Ab Initio Study

✍ Wiktor Zierkiewicz; Danuta Michalska; Zdenek Havlas; Pavel Hobza 📂 Article 📅 2002 🏛 John Wiley and Sons 🌐 English ⚖ 123 KB 👁 3 views

The role of charge-site location in frag

The role of charge-site location in fragmenting ions. 1—[CH3 CHXCOOCH3]+˙ and [CH2XCH2 COOCH3]+˙ ions and the structures of daughter ions derived from the loss of X (X = I, Br, Cl and CH3)

✍ Peter C. Burgers; J. L. Holmes; F. P. Lossing; Frank R. Povel; Johan K. Terlouw 📂 Article 📅 1983 🏛 John Wiley and Sons 🌐 English ⚖ 495 KB

Conformational equilibria in dihalohepta

Conformational equilibria in dihaloheptasilanes X2Si[SiMe(SiMe3)2]2 with X = F, Cl, Br, I: A Raman spectroscopic and quantum chemical DFT study

✍ A. Dzambaski; M. Flock; K. Hassler 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 484 KB

## Abstract Equilibrium geometries, stabilities and vibrational wavenumbers for conformers of the dihaloheptasilanes X~2~Si[SiMe(SiMe~3~)~2~]~2~ with X = F, Cl, Br and I were calculated at the density functional B3LYP level employing 6‐311G(d) basis sets and SDD pseudopotentials for Br and I. Two s