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The CeO 2+ Cation: Gas-Phase Reactivity and Electronic Structure

✍ Scribed by Heinemann, Christoph; Cornehl, Hans H.; Schröder, Detlef; Dolg, Michael; Schwarz, Helmut


Book ID
126172725
Publisher
American Chemical Society
Year
1996
Tongue
English
Weight
420 KB
Volume
35
Category
Article
ISSN
0020-1669

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The phenylsulfenium cation: Electronic s
✍ Olga Bortolini; Alessandra Guerrini; Vittorio Lucchini; Giorgio Modena; Lucia Pa 📂 Article 📅 1999 🏛 Elsevier Science 🌐 French ⚖ 207 KB

The energies and the geometries of the phenylsulfenium cation (PhS +) in the singlet and triplet states have been optimized ab initio at the MP216-31G\*IIMP216-31G\* level. The (1A) PhS + state is more stable by 63.0 kJ mol "1 than the (3A) PhS + state. The PhS + ion reacts in the gas-phase with eth