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Updated: Feb 11, 2026

Computation of Atmospheric Concentrations of Molecular Clusters from ab initio Thermochemistry
Published on: April 8, 2020
[Mo12 S12 O12 (OH)12 (H2 O)6 ]: A Cyclic Molecular Cluster Based on the [Mo2 S2 O2 ]2+ Building Block
Emmanuel Cadot1, Bernadette Salignac1, Sabine Halut2
1Institut Lavoisier, UMR C 173 du CNRS, Université de Versailles Saint-Quentin, 45 avenue des Etats-Unis, 78035 Versailles (France), Fax: (+33) 1-39254381.
Abstract:
The pH-dependent self-condensation of the [Mo2 S2 O2 ]2+ complex fragment gives the wheellike Mo12 cluster depicted on the right (ball-and-stick model; large balls: S, medium balls: O, small balls: Mo). Applying this synthetic strategy to other starting materials could provide access to other polyoxothiometalates with well-defined cavities.
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