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Manuscript title: Dual Co/Photoredox-Catalyzed Regio- and Stereoselective Synthesis of Highly Functional 1,3-Dienes
Journal: Angew. Chem. Int. Ed.
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Funes, Ignacio | |
| dc.date.accessioned | 2025-12-09T14:46:46Z | - |
| dc.date.available | 2026-05-28T10:30:31Z | - |
| dc.date.created | 2025-12-09T15:44:38.77958+01:00 | |
| dc.date.issued | 2025-12-09T15:44:38.77958+01:00 | |
| dc.identifier.uri | https://iochem-bd.bsc.es/browse/handle/100/480570 | - |
| dc.description.abstract | 6_syn_S | |
| dc.publisher | IQUR | |
| dc.relation | Original title: Dual Co/Photoredox-Catalyzed Regio- and Stereoselective Synthesis of Highly Functional 1,3-Dienes DOI: 10.1002/anie.202522561 Journal: Angew. Chem. Int. Ed. | * |
| dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-6-609 | - |
| dc.relation.uri | http://dx.doi.org/10.1002/anie.202522561 | * |
| dc.rights | CC BY 4.0 (c) Barcelona Supercomputing Center, 2025 | |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | |
| dc.subject | Density functional calculations | |
| dc.subject | Cobalt | |
| dc.title | 6_syn_S | |
| dc.type | dataset | |
| cml.program.name | Gaussian | |
| cml.program.version | 16 | |
| cml.program.other | ES64L-G16RevC.02 | |
| cml.method | RwB97XD | |
| cml.method | RM06L | |
| cml.method | RM06 | |
| cml.method | RPBE1PBE | |
| cml.basisset | DEF2SVP DEF2TZVPP | |
| cml.multiplicity | 1 | |
| cml.spintype | Restricted Restricted Restricted Restricted | |
| cml.shelltype | Closed | |
| cml.charge | 0 | |
| cml.energy.value | -657.1197809 | |
| cml.energy.units | Eh | |
| cml.formula.generic | C15H18O | |
| cml.calculationtype | Geometry optimization Minimum | |
| cml.hassolvent | true | |
| cml.hasvibrationalfrequencies | true | |
| cml.numberofjobs | 6 | |
| cml.hasmolecularorbitals | false | |
| Appears in Collections: | ACIE_Cobalt_Enyne - DOI: 10.19061/iochem-bd-6-609 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.bsc.es/browse/handle/100/480570
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