✦ LIBER ✦

Spectroscopic calculations of CH and OH bond dissociation energies for aldehydes, ketones, acids, and alcohols

✍ Scribed by L. A. Gribov; I. A. Novakov; A. I. Pavlyuchko; O. Yu. Shumovskii

Book ID: 106427417
Publisher: SP MAIK Nauka/Interperiodica
Year: 2007
Tongue: English
Weight: 111 KB
Volume: 48
Category: Article
ISSN: 0022-4766
DOI: 10.1007/s10947-007-0093-x

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Spectroscopic calculations of CH bond di

Spectroscopic calculations of CH bond dissociation energies for ethene, propene, and benzene chlorine derivatives

✍ L. A. Gribov; I. A. Novakov; A. I. Pavlyuchko; E. V. Vasiliev 📂 Article 📅 2007 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 105 KB

“Spectroscopic” Calculation of CH and NH

“Spectroscopic” Calculation of CH and NH Bond Dissociation Energies for a Series of Primary Amines

✍ L. A. Gribov; I. A. Novakov; A. I. Pavlyuchko; V. V. Korolkov; B. S. Orlinson 📂 Article 📅 2004 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 317 KB

“Spectroscopic” Calculations of CH Bond

“Spectroscopic” Calculations of CH Bond Dissociation Energies for Ethane, Propane, Butane, Isobutane, Pentane, Hexane, and Neopentane Using Fundamental Vibration Frequencies

✍ L. A. Gribov; I. A. Novakov; A. I. Pavlyuchko; I. O. Kulago; B. S. Orlinson 📂 Article 📅 2003 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 111 KB

Spectroscopic calculation of the bond-di

Spectroscopic calculation of the bond-dissociation energy of CH bonds in fluoro derivatives of methane, ethane, ethene, propene, and benzene

✍ L. A. Gribov; I. A. Novakov; A. I. Pavlyuchko; O. Yu. Shumovskii 📂 Article 📅 2007 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 109 KB

Spectroscopic calculation of CH bond dis

Spectroscopic calculation of CH bond dissociation energy in the series of chloro derivatives of methane, ethane, and propane

✍ L. A. Gribov; I. A. Novakov; A. I. Pavlyuchko; E. V. Vasil’ev 📂 Article 📅 2006 🏛 SP MAIK Nauka/Interperiodica 🌐 English ⚖ 107 KB

Bond dissociation energies for removal o

Bond dissociation energies for removal of the hydroxyl group in some alcohols from quantum chemical calculations

✍ Jun Zhao; Hui Zeng; Xinlu Cheng 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 102 KB

## Abstract In this theoretical work, 22 alcohols and their geometric structure properties have been investigated employing quantum chemical methods to calculate the COH equilibrium bond distances and bond dissociation energies (BDEs). Since DFT methods have been researched to have low basis sets