✦ LIBER ✦

Steric forces in substituted aromatics: conformation of the hexahalobenzenes as determined by ab initio calculations

✍ Scribed by Almloef, Jan; Faegri, Knut

Book ID: 126087700
Publisher: American Chemical Society
Year: 1983
Tongue: English
Weight: 707 KB
Volume: 105
Category: Article
ISSN: 0002-7863
DOI: 10.1021/ja00348a007

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Molecular structure of the inner and out

Molecular structure of the inner and outer conformers of methylhydrazine as determined by gas electron diffraction and ab initio mo calculation

✍ Norio Murase; Kaoru Yamanouchi; Toru Egawa; Kozo Kuchitzu 📂 Article 📅 1991 🏛 Elsevier Science 🌐 English ⚖ 621 KB

Molecular Structure of 3,3-Diethylpentan

Molecular Structure of 3,3-Diethylpentane (Tetraethylmethane) in the Gas Phase As Determined by Electron Diffraction and ab Initio Calculations

✍ Alder, Roger W.; Allen, Paul R.; Hnyk, Drahomír; Rankin, David W. H.; Robertson, 📂 Article 📅 1999 🏛 American Chemical Society 🌐 English ⚖ 79 KB

The non-bonded interactions in D-glucose

The non-bonded interactions in D-glucose and β-maltose: an ab initio study of conformations produced by empirical force-field calculations

✍ Steen Melberg; Kjeld Rasmussen; Raimondo Scordamaglia; Camillo Tosi 📂 Article 📅 1979 🏛 Elsevier Science 🌐 English ⚖ 917 KB

The Molecular Structures and Conformatio

The Molecular Structures and Conformations of Bis(dichlorosilyl)amine and Bis(dichlorosilyl)methylamine in the Gas Phase: Determination by Electron Diffraction and by ab Initio Calculations

✍ Fleischer, Holger ;Hnyka, Drahomir ;Rankin, David W. H. ;Robertson, Heather E. ; 📂 Article 📅 1995 🏛 Wiley (John Wiley & Sons) 🌐 English ⚖ 877 KB

The gas-phase molecular structures of bis(dichlorosily1)amine, (HSiCl,),NH, and bis(dichlorosilyl)methylamine, (SiHCl,),NMe, have been investigated by electron diffraction and ab initio calculations on a MP2/6-31G\* level. Because the latter suggest the presence of a mixture of two conformers for ea

Conformers of Guanosines and their Vibra

Conformers of Guanosines and their Vibrations in the Electronic Ground and Excited States, as Revealed by Double-Resonance Spectroscopy and Ab Initio Calculations

✍ Eyal Nir; Isabel Hünig; Karl Kleinermanns; Mattanjah S. de Vries 📂 Article 📅 2004 🏛 John Wiley and Sons 🌐 English ⚖ 269 KB 👁 1 views

Vibrational Frequencies and Conformation

Vibrational Frequencies and Conformational Stability of 1,4-Cyclohexanedione in the Gas Phase As Studied by Infrared and Raman Spectroscopy and ab Initio Calculations

✍ Egawa, Toru; del Rosario, Arnold; Morris, Kevin; Laane, Jaan 📂 Article 📅 1997 🏛 American Chemical Society 🌐 English ⚖ 119 KB