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Coburger, Peter; Kahraman, Gizem; Straube, Axel; Hey-Hawkins, Evamarie
<?xml version='1.0' encoding='utf-8'?> <resource xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xmlns="http://datacite.org/schema/kernel-4" xsi:schemaLocation="http://datacite.org/schema/kernel-4 http://schema.datacite.org/meta/kernel-4.1/metadata.xsd"> <identifier identifierType="URL">https://aperta.ulakbim.gov.tr/record/69587</identifier> <creators> <creator> <creatorName>Coburger, Peter</creatorName> <givenName>Peter</givenName> <familyName>Coburger</familyName> <affiliation>Univ Leipzig, Fac Chem & Mineral, Inst Inorgan Chem, Johannisallee 29, D-04103 Leipzig, Germany</affiliation> </creator> <creator> <creatorName>Kahraman, Gizem</creatorName> <givenName>Gizem</givenName> <familyName>Kahraman</familyName> </creator> <creator> <creatorName>Straube, Axel</creatorName> <givenName>Axel</givenName> <familyName>Straube</familyName> <affiliation>Univ Leipzig, Fac Chem & Mineral, Inst Inorgan Chem, Johannisallee 29, D-04103 Leipzig, Germany</affiliation> </creator> <creator> <creatorName>Hey-Hawkins, Evamarie</creatorName> <givenName>Evamarie</givenName> <familyName>Hey-Hawkins</familyName> <affiliation>Univ Leipzig, Fac Chem & Mineral, Inst Inorgan Chem, Johannisallee 29, D-04103 Leipzig, Germany</affiliation> </creator> </creators> <titles> <title>Rhodium(I) Complexes With Carborane-Substituted P,N Ligands: Investigations Of Electronic Structure And Dynamic Behaviour</title> </titles> <publisher>Aperta</publisher> <publicationYear>2019</publicationYear> <dates> <date dateType="Issued">2019-01-01</date> </dates> <resourceType resourceTypeGeneral="Text">Journal article</resourceType> <alternateIdentifiers> <alternateIdentifier alternateIdentifierType="url">https://aperta.ulakbim.gov.tr/record/69587</alternateIdentifier> </alternateIdentifiers> <relatedIdentifiers> <relatedIdentifier relatedIdentifierType="DOI" relationType="IsIdenticalTo">10.1039/c9dt00628a</relatedIdentifier> </relatedIdentifiers> <rightsList> <rights rightsURI="http://www.opendefinition.org/licenses/cc-by">Creative Commons Attribution</rights> <rights rightsURI="info:eu-repo/semantics/openAccess">Open Access</rights> </rightsList> <descriptions> <description descriptionType="Abstract">Two distorted square-planar Rh-I complexes (1 and 2) were obtained from [{RhCl(eta(4)-cod)}(2)] and the respective P,N ligands. The metal-ligand interaction was probed with density functional theory (DFT) and ab initio (CASSCF-NEVPT2) calculations. NMR spectroscopy proved dynamic binding behaviour of the ligands in solution. The tetradenticity of the ligands also affects the electrochemical behaviour of complexes 1 and 2 significantly. Finally, preliminary catalytic studies, namely the dehydrocoupling of dimethylamine-borane, are presented.</description> </descriptions> </resource>
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