Stepwise Oxidations in a Cofacial Copper(II) Porphyrin Dimer: Through-Space Spin-Coupling and Interplay between Metal and Radical Spins

Keyphrases

• Ab Initio Molecular Dynamics 33%
• Antiferromagnetic Coupling 33%
• Closely Spaced 33%
• Copper Porphyrin 100%
• Counterion 33%
• Cu(II) 100%
• DFT Calculations 33%
• Electronic Communication 33%
• Energy Barrier 33%
• Ethene 33%
• Iodide Ion 33%
• Iodine 33%
• Isomerization Mechanism 33%
• Linker 33%
• Macrocycles 33%
• Magnetic Studies 33%
• Porphyrin 100%
• Porphyrin Dimers 100%
• Porphyrin Macrocycles 66%
• Pyramidal Structure 33%
• Radical Cation 100%
• Spectroscopic Investigation 33%
• Spin Coupling 100%
• Structural Details 33%
• Through-bond 33%
• Through-space 100%
• Trans Isomers 33%
• Trigonal 33%
• Triplet State 33%
• Variable Temperature 33%
• X-ray Structure 33%

Chemistry

• Antiferromagnetic 33%
• Counterion 33%
• Density Functional Theory 33%
• dimer 100%
• electronics 33%
• Energy Barrier 33%
• Ethylene 33%
• Isomerization 33%
• Macrocycle 100%
• Magnetic Temperature 33%
• Molecular Dynamics 33%
• Radical Cation 100%
• Spectroscopy 33%
• Trans Isomer 33%
• Triplet State 33%