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Referenced by:
Manuscript title: C–S Couplings Catalyzed by Ni(II) Complexes of the Type [(NHC)Ni(Cp)(Br)]
Journal: J. Catal.
Full metadata record
DC Field | Value | Language |
---|---|---|
dc.contributor.author | Mollfulleda, Rosa | - |
dc.coverage.spatial | ES Girona | - |
dc.date.accessioned | 2023-04-18T08:49:03Z | - |
dc.date.available | 2023-11-02T14:18:05Z | - |
dc.date.created | 2023-04-18T10:49:01.502+02:00 | - |
dc.date.issued | 2023-04-18T10:49:01.502+02:00 | - |
dc.identifier.uri | https://iochem.udg.edu:8443/browse/handle/100/4725 | - |
dc.description | Frequencies of complex 1 with SBzCl2 in conformation b and singlet spin state | - |
dc.publisher | UdG | - |
dc.relation | Original title: C–S Couplings Catalyzed by Ni(II) Complexes of the Type [(NHC)Ni(Cp)(Br)] DOI: 10.1016/j.jcat.2023.07.001 Journal: J. Catal. | * |
dc.relation.ispartof | http://dx.doi.org/10.19061/iochem-bd-4-59 | - |
dc.relation.uri | http://dx.doi.org/10.1016/j.jcat.2023.07.001 | * |
dc.rights | CC BY 4.0 (c) UdG, 2023 | - |
dc.rights.uri | http://creativecommons.org/licenses/by/4.0/ | - |
dc.title | frq_opt_nIb_BzCl2_0_1 | - |
dc.type | dataset | - |
dc.date.updated | 2023-04-18T08:49:03Z | - |
cml.program.name | ADF | en |
cml.program.version | 2019 | en |
cml.program.other | 304 | en |
cml.method | S12g-x PBEc | en |
cml.basisset | TZ2P | en |
cml.multiplicity | 1 | en |
cml.spintype | UNrestricted | en |
cml.charge | 0 | en |
cml.formula.generic | C38H30Cl4N2NiS2 | en |
cml.calculationtype | Single point | en |
cml.hassolvent | true | en |
cml.hasvibrationalfrequencies | true | en |
cml.numberofjobs | 1 | en |
cml.hasmolecularorbitals | false | en |
Appears in Collections: | The_Thioetherification_reaction - DOI: 10.19061/iochem-bd-4-59 |
Please use this identifier to cite or link to this item:
https://iochem.udg.edu/browse/handle/100/4725