ioChem-BD Browse module - Item page
Item metadata and files
Code snippets
Referenced by:
Manuscript title: Origin of the selectivity in the ring-closing metathesis step of the synthesis of (−)-callyspongiolide: Formation of fourteen-versus eight-membered rings
Journal: Tetrahedron
Full metadata record
| DC Field | Value | Language |
|---|---|---|
| dc.contributor.author | Díaz-Ruiz, Marina | - |
| dc.date.accessioned | 2022-08-02T07:50:04Z | - |
| dc.date.available | 2022-09-06T09:11:24Z | - |
| dc.date.created | 2022-08-02T09:50:02.242+02:00 | - |
| dc.date.issued | 2022-08-02T09:50:02.242+02:00 | - |
| dc.identifier.uri | https://iochem-bd.iciq.es/browse/handle/100/41094 | - |
| dc.description | B-rot | - |
| dc.publisher | Institute of Chemical Research of Catalonia | - |
| dc.relation | Original title: Origin of the selectivity in the ring-closing metathesis step of the synthesis of (−)-callyspongiolide: Formation of fourteen-versus eight-membered rings DOI: 10.1016/j.tet.2022.133016 Journal: Tetrahedron | * |
| dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-1-253 | - |
| dc.relation.uri | http://dx.doi.org/10.1016/j.tet.2022.133016 | * |
| dc.rights | CC BY 4.0 (c) Institute of Chemical Research of Catalonia, 2022 | - |
| dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
| dc.title | B-rot | - |
| dc.type | dataset | - |
| dc.date.updated | 2022-08-02T07:50:04Z | - |
| cml.program.name | Gaussian | en |
| cml.program.version | 16 | en |
| cml.program.other | AM64L-G16RevA.03 | en |
| cml.method | RB3LYP | en |
| cml.basisset | CC-PVTZ GENECP | en |
| cml.multiplicity | 1 | en |
| cml.spintype | Restricted | en |
| cml.shelltype | Closed | en |
| cml.charge | 0 | en |
| cml.energy.value | -3141.5472129 | en |
| cml.energy.units | Eh | en |
| cml.formula.generic | C46H62Cl2N2O3Ru | en |
| cml.calculationtype | Single point Structure | en |
| cml.hassolvent | true | en |
| cml.hasvibrationalfrequencies | false | en |
| cml.numberofjobs | 1 | en |
| cml.hasmolecularorbitals | false | en |
| Appears in Collections: | Ring-closing metathesis - DOI: 10.19061/iochem-bd-1-253 | |
Please use this identifier to cite or link to this item:
https://iochem-bd.iciq.es/browse/handle/100/41094
Item files in Browse 
HTML5 resume (see conditions inside)