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Manuscript title: Divergent housane synthesis via intramolecular [2 + 2] cycloaddition of 1,4-dienes
Metadata:
| Title: | 2av_MD_Initialization |
| Authors: | Hölter, Niklas |
| Keywords: | Housane EnT Energy Transfer Energy Transfer Catalysis |
| Issue Date: | 29-Sep-2025 |
| Publisher: | Institute of Organic Chemistry, University of Münster |
| Abstract: | Optimization and high precision frequency calculation for initializing the MD simulation of 2av using milo |
| URI: | https://iochem-bd.bsc.es/browse/handle/100/478906 |
| Appears in Collections: | Computational Data for EnT-photocatalzyed synthesis of housanes by intramolecular [2+2] cycloaddition - DOI: 10.19061/iochem-bd-6-583 |
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https://iochem-bd.bsc.es/browse/handle/100/478906
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