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The Mechanism of the Formation of Quinones from Monophenols with Dipotassium Nitrosobissulfate

✍ Scribed by Prof. Dr. H.-J. Teuber; Dipl.-Chem. K. H. Dietz


Publisher
John Wiley and Sons
Year
1965
Tongue
English
Weight
220 KB
Volume
4
Category
Article
ISSN
0044-8249

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Ab initio study of the formation of C3H3
✍ LοΏ½pez, RamοΏ½n; Sordo, JosοΏ½ A.; Sordo, TomοΏ½s L.; von RaguοΏ½ Schleyer, Paul πŸ“‚ Article πŸ“… 1996 πŸ› John Wiley and Sons 🌐 English βš– 366 KB πŸ‘ 2 views

Ab initio molecular orbital theory has been used to study the mechanism of the formation of C,H, ' from the reaction of CH,+ with acetylene. The highest level geometry optimizations and frequencies were computed at MP2-FC/6-31G\* \* ; single point energies of all the critical structures were compute