DC Field | Value | Language |
---|---|---|
dc.contributor.author | Pal, Raja | ko |
dc.contributor.author | Kim, Suyeon | ko |
dc.contributor.author | Lee, Woojong | ko |
dc.contributor.author | Mena, Matthew R. | ko |
dc.contributor.author | Khurshid, Afshan | ko |
dc.contributor.author | Ghosh, Chandrani | ko |
dc.contributor.author | Groy, Thomas L. | ko |
dc.contributor.author | Chizmeshya, Andrew V. G. | ko |
dc.contributor.author | Baik, Mu-Hyun | ko |
dc.contributor.author | Trovitch, Ryan J. | ko |
dc.date.accessioned | 2021-07-06T02:50:30Z | - |
dc.date.available | 2021-07-06T02:50:30Z | - |
dc.date.created | 2021-07-05 | - |
dc.date.created | 2021-07-05 | - |
dc.date.created | 2021-07-05 | - |
dc.date.issued | 2021-06 | - |
dc.identifier.citation | INORGANIC CHEMISTRY, v.60, no.11, pp.7708 - 7718 | - |
dc.identifier.issn | 0020-1669 | - |
dc.identifier.uri | http://hdl.handle.net/10203/286418 | - |
dc.description.abstract | Refluxing Mo(CO)(6) in the presence of the phosphine-functionalized alpha-diimine ligand (DI)-D-Ph2PPr allowed for substitution and formation of the dicarbonyl complex, ((DI)-D-Ph2PPr)-Mo(CO)(2). Oxidation with I-2 followed by heating resulted in further CO dissociation and isolation of the corresponding diiodide complex, ((DI)-D-Ph2PPr)MoI2. Reduction of this complex under a N-2 atmosphere afforded the corresponding bis(dinitrogen) complex, ((DI)-D-Ph2PPr)Mo(N-2)(2). The solid-state structures of all three compounds were found to feature a tetradentate chelate and cis-monodentate ligands. Notably, the addition of CO2 to ((DI)-D-Ph2PPr)-MO(N-2)(2) is proposed to result in head-to-tail CO2 coupling to generate the corresponding metallacycle and ultimately a mixture of ((DI)-D-Ph2PPr)Mo(CO)(2) and the bis(oxo) dimer, [(kappa(3)-(DI)-D-Ph2PPr)Mo(O)(mu-O)](2). Computational studies have been performed to gain insight into the reaction and evaluate the importance of cis-coordination sites for selective head-to-tail CO2 reductive coupling, CO deinsertion, disproportionation, and stepwise CO2 deinsertion. | - |
dc.language | English | - |
dc.publisher | AMER CHEMICAL SOC | - |
dc.title | Reaction of a Molybdenum Bis(dinitrogen) Complex with Carbon Dioxide: A Combined Experimental and Computational Investigation | - |
dc.type | Article | - |
dc.identifier.wosid | 000661306200016 | - |
dc.identifier.scopusid | 2-s2.0-85107902782 | - |
dc.type.rims | ART | - |
dc.citation.volume | 60 | - |
dc.citation.issue | 11 | - |
dc.citation.beginningpage | 7708 | - |
dc.citation.endingpage | 7718 | - |
dc.citation.publicationname | INORGANIC CHEMISTRY | - |
dc.identifier.doi | 10.1021/acs.inorgchem.1c00003 | - |
dc.contributor.localauthor | Baik, Mu-Hyun | - |
dc.contributor.nonIdAuthor | Pal, Raja | - |
dc.contributor.nonIdAuthor | Mena, Matthew R. | - |
dc.contributor.nonIdAuthor | Khurshid, Afshan | - |
dc.contributor.nonIdAuthor | Ghosh, Chandrani | - |
dc.contributor.nonIdAuthor | Groy, Thomas L. | - |
dc.contributor.nonIdAuthor | Chizmeshya, Andrew V. G. | - |
dc.contributor.nonIdAuthor | Trovitch, Ryan J. | - |
dc.description.isOpenAccess | N | - |
dc.type.journalArticle | Article | - |
dc.subject.keywordPlus | X-RAY-STRUCTURE | - |
dc.subject.keywordPlus | REDUCTIVE DISPROPORTIONATION | - |
dc.subject.keywordPlus | ELECTROCATALYTIC REDUCTION | - |
dc.subject.keywordPlus | MOLECULAR CALCULATIONS | - |
dc.subject.keywordPlus | DIIMINE LIGANDS | - |
dc.subject.keywordPlus | BASIS-SETS | - |
dc.subject.keywordPlus | CO2 | - |
dc.subject.keywordPlus | NICKEL | - |
dc.subject.keywordPlus | HYDROSILYLATION | - |
dc.subject.keywordPlus | CHEMISTRY | - |
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