| Autor: |
Sutula, V. D., Zeif, A. P., Popov, B. I., Vadash, P. I. |
| Zdroj: |
Reaction Kinetics and Catalysis Letters; March 1978, Vol. 9 Issue: 1 p79-83, 5p |
| Abstrakt: |
The energy of interaction between a methanol molecule and an MoO42− group of the Fe2(MoO4)3 and Ga2(MoO4)3 lattice, and the force constant of the C−H bond calculated by the INDO method show that the deformation of MoO42− tetrahedra leading to the displacement of Mo6+ to the edge attacked, increase the stabilizing contribution to the energy and decrease the C−H force constant. This effect is maximal at 1Mo−O≃2 Å. |
| Databáze: |
Supplemental Index |
| Externí odkaz: |
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