0000000001309830

AUTHOR

Stefan Lochbrunner

showing 17 related works from this author

Cover Picture: Photo-Chromium: Sensitizer for Visible-Light-Induced Oxidative C−H Bond Functionalization-Electron or Energy Transfer? (ChemPhotoChem …

2017

ChemistrySinglet oxygenOrganic Chemistrychemistry.chemical_elementOxidative phosphorylationElectronPhotochemistryAnalytical ChemistryChromiumchemistry.chemical_compoundPhotocatalysisSurface modificationCover (algebra)Physical and Theoretical ChemistryVisible spectrumChemPhotoChem
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Distinct photodynamics of κ-N and κ-C pseudoisomeric iron(ii) complexes

2021

Two closely related FeII complexes with 2,6-bis(1-ethyl-1H-1,2,3-triazol-4yl)pyridine and 2,6-bis(1,2,3-triazol-5-ylidene)pyridine ligands are presented to gain new insights into the photophysics of bis(tridentate) iron(II) complexes. The [Fe(N^N^N)2]2+ pseudoisomer sensitizes singlet oxygen through a MC state with nanosecond lifetime after MLCT excitation, while the bis(tridentate) [Fe(C^N^C)2]2+ pseudoisomer possesses a similar 3MLCT lifetime as the tris(bidentate) [Fe(C^C)2(N^N)]2+ complexes with four mesoionic carbenes. Financial support from the Deutsche Forschungsge-meinschaft [DFG, Priority Program SPP 2102] "Light-controlled reactivity of metal complexes" (BA 4467/7-1, LO 714/11-1, …

TrisDenticitysynthesisPyridinepyridine derivativecarbenoidIron compoundsCatalysisexperimental studychemistry.chemical_compoundPyridineMaterials Chemistryphysical chemistrycontrolled studyChemistrySinglet oxygenPyridine ligandsSinglet oxygenMetals and AlloysMesoionicGeneral ChemistryNanosecondPyridine ligandSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialsunclassified drugCrystallographyPhotophysicsiron complexisomerCeramics and CompositesCarbeneschemical structurephotodynamicsphysicsExcitationchemical parameters
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Gold(II) Porphyrins in Photoinduced Electron Transfer Reactions

2019

Chemistry - a European journal 25(23), 5940 - 5949 (2019). doi:10.1002/chem.201900050

010405 organic chemistryArylOrganic ChemistryPhotoredox catalysisGeneral Chemistry010402 general chemistryPhotochemistry54001 natural sciencesRedoxPorphyrinCatalysisPhotoinduced electron transfer0104 chemical scienceslaw.inventionchemistry.chemical_compoundElectron transferchemistrylawddc:540AzideElectron paramagnetic resonance
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Higher MLCT lifetime of carbene iron(ii) complexes by chelate ring expansion

2021

Combining strong σ-donating N-heterocyclic carbene ligands and π-accepting pyridine ligands with a high octahedricity in rigid iron(ii) complexes increases the 3MLCT lifetime from 0.15 ps in the prototypical [Fe(tpy)2]2+ complex to 9.2 ps in [Fe(dpmi)2]2+12+. The tripodal CNN ligand dpmi (di(pyridine-2-yl)(3-methylimidazol-2-yl)methane) forms six-membered chelate rings with the iron(ii) centre leading to close to 90° bite angles and enhanced iron-ligand orbital overlap.

010405 organic chemistryLigandMetals and AlloysGeneral ChemistryOrbital overlap010402 general chemistryRing (chemistry)01 natural sciencesCatalysisPyridine ligand0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialschemistry.chemical_compoundCrystallographychemistryMaterials ChemistryCeramics and CompositesChelationCarbeneChemical Communications
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Green-Light Activation of Push-Pull Ruthenium(II) Complexes.

2020

Abstract Synthesis, characterization, electrochemistry, and photophysics of homo‐ and heteroleptic ruthenium(II) complexes [Ru(cpmp)2]2+ (22+) and [Ru(cpmp)(ddpd)]2+ (32+) bearing the tridentate ligands 6,2’’‐carboxypyridyl‐2,2’‐methylamine‐pyridyl‐pyridine (cpmp) and N,N’‐dimethyl‐N,N’‐dipyridin‐2‐ylpyridine‐2,6‐diamine (ddpd) are reported. The complexes possess one (32+) or two (22+) electron‐deficient dipyridyl ketone fragments as electron‐accepting sites enabling intraligand charge transfer (ILCT), ligand‐to‐ligand charge transfer (LL'CT) and low‐energy metal‐to‐ligand charge transfer (MLCT) absorptions. The latter peak around 544 nm (green light). Complex 22+ shows 3MLCT phosphorescenc…

chemistry.chemical_elementQuantum yield010402 general chemistryElectrochemistryPhotochemistry01 natural sciencesCatalysisPhotoinduced electron transferchemistry.chemical_compoundPhotochemistry | Very Important PaperluminescenceAcetonitrilerutheniumphotophysicsphotochemistryFull Paper010405 organic chemistryChemistryOrganic ChemistryGeneral ChemistryFull Papers0104 chemical sciencesRutheniumExcited stateLuminescencePhosphorescencephotocatalysisChemistry (Weinheim an der Bergstrasse, Germany)
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Ground- and Excited-State Properties of Iron(II) Complexes Linked to Organic Chromophores

2020

Two new bichromophoric complexes, [Fe(bim-ant)2]2+ and [Fe(bim-pyr)2]2+ ([H2-bim]2+ = 1,1′-(pyridine-2,6-diyl)bis(3-methyl-1H-imidazol-3-ium); ant = 9-anthracenyl; pyr = 1-pyrenyl), are investigate...

Inorganic ChemistryCrystallography010405 organic chemistryChemistryExcited statePhysical and Theoretical ChemistryChromophore010402 general chemistry01 natural sciences0104 chemical sciencesInorganic Chemistry
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Photo-Chromium: Sensitizer for Visible-Light-Induced Oxidative C−H Bond Functionalization-Electron or Energy Transfer?

2017

The chromium(III) sensitizer [Cr(ddpd)2]3+ - based on an earth-abundant metal center - possesses a unique excited state potential energy landscape (ddpd = N,N'-dimethyl-N,N'-dipyridine-2-ylpyridine-2,6-diamine). The very large energy gap between the redox active and substitutionally labile 4T2 state and the long-lived low-energy 2E spin-flip state enables a selective, efficient sensitization of triplet dioxygen to give singlet dioxygen. Ultrafast intersystem crossing after the Franck Condon point from the 4T2 to the 2E excited state within 3.5 ps precludes intermolecular electron transfer pathways from the ultrashort-lived excited 4T2 state. This specific excited state reactivity enables a …

010405 organic chemistrySinglet oxygenOrganic ChemistryIntermolecular forcechemistry.chemical_element010402 general chemistryPhotochemistry01 natural sciences0104 chemical sciencesAnalytical Chemistrychemistry.chemical_compoundChromiumElectron transferIntersystem crossingchemistryExcited stateSinglet fissionReactivity (chemistry)Physical and Theoretical ChemistryChemPhotoChem
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Cover Feature: Excited‐State Kinetics of an Air‐Stable Cyclometalated Iron(II) Complex (Chem. Eur. J. 51/2019)

2019

Feature (computer vision)Chemical physicsChemistryExcited stateOrganic ChemistryKineticsCover (algebra)General ChemistryCatalysisChemistry – A European Journal
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A Vanadium(III) Complex with Blue and NIR-II Spin-Flip Luminescence in Solution.

2020

Luminescence from Earth-abundant metal ions in solution at room temperature is a very challenging objective due to the intrinsically weak ligand field splitting of first-row transition metal ions, which leads to efficient nonradiative deactivation via metal-centered states. Only a handful of 3d

Ligand field theoryChemistryMetal ions in aqueous solutionVanadiumchemistry.chemical_elementGeneral Chemistry010402 general chemistryPhotochemistry01 natural sciencesBiochemistryCatalysisTransition metal ions0104 chemical sciencesCondensed Matter::Materials ScienceColloid and Surface ChemistryPhysics::Plasma PhysicsSpin-flipLuminescenceJournal of the American Chemical Society
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Ultrafast and long-time excited state kinetics of an NIR-emissive vanadium(iii) complex I: synthesis, spectroscopy and static quantum chemistry.

2021

In spite of intense, recent research efforts, luminescent transition metal complexes with Earth-abundant metals are still very rare owing to the small ligand field splitting of 3d transition metal complexes and the resulting non-emissive low-energy metal-centered states. Low-energy excited states decay efficiently non-radiatively, so that near-infrared emissive transition metal complexes with 3d transition metals are even more challenging. We report that the heteroleptic pseudo-octahedral d2-vanadium(iii) complex VCl3(ddpd) (ddpd = N,N′-dimethyl-N,N′-dipyridine-2-yl-pyridine-2,6-diamine) shows near-infrared singlet → triplet spin–flip phosphorescence maxima at 1102, 1219 and 1256 nm with a …

Ligand field theoryPhotoluminescenceMaterials science010405 organic chemistryGeneral Chemistry010402 general chemistryPhotochemistry01 natural sciencesQuantum chemistry0104 chemical sciencesChemistryTransition metalExcited stateSinglet stateSpectroscopyPhosphorescenceChemical science
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Excited-State Kinetics of an Air-Stable Cyclometalated Iron(II) Complex.

2019

The complex class [Fe(N^N^C)(N^N^N)]+ with an Earth-abundant metal ion has been repeatedly suggested as a chromophore and potential photosensitizer on the basis of quantum chemical calculations. Synthesis and photophysical properties of the parent complex [Fe(pbpy)(tpy)]+ (Hpbpy=6-phenyl-2,2'-bipyridine and tpy=2,2':6',2''-terpyridine) of this new chromophore class are now reported. Ground-state characterization by X-ray diffraction, electrochemistry, spectroelectrochemistry, UV/Vis, and X-ray spectroscopy in combination with DFT calculations proves the high impact of the cyclometalating ligand on the electronic structure. The photophysical properties are significantly improved compared to …

010405 organic chemistryChemistryLigandOrganic ChemistryChemieGeneral ChemistryElectronic structureChromophore010402 general chemistryElectrochemistryPhotochemistry01 natural sciencesCatalysis0104 chemical scienceschemistry.chemical_compoundBipyridineExcited stateTriplet stateTerpyridineChemistry (Weinheim an der Bergstrasse, Germany)
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Cover Feature: Green‐Light Activation of Push–Pull Ruthenium(II) Complexes (Chem. Eur. J. 30/2020)

2020

chemistryFeature (computer vision)Organic ChemistryPhotocatalysischemistry.chemical_elementCover (algebra)General ChemistryGreen-lightLuminescencePhotochemistryCatalysisPush pullRutheniumChemistry – A European Journal
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CCDC 1958562: Experimental Crystal Structure Determination

2020

Related Article: Matthias Dorn, Jens Kalmbach, Pit Boden, Ayla Päpcke, Sandra Gómez, Christoph Förster, Felix Kuczelinis, Luca M. Carrella, Laura A. Büldt, Nicolas H. Bings, Eva Rentschler, Stefan Lochbrunner, Leticia González, Markus Gerhards, Michael Seitz, Katja Heinze|2020|J.Am.Chem.Soc.|142|7947|doi:10.1021/jacs.0c02122

Space GroupCrystallographymer-bis(N2N6-dimethyl-N2N6-bis(pyridin-2-yl)pyridine-26-diamine)-vanadium(iii) tris(hexafluorophosphate) acetonitrile solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2050317: Experimental Crystal Structure Determination

2021

Related Article: Philipp Dierks, Ayla Kruse, Olga S. Bokareva, Mohammed J. Al-Marri, Jens Kalmbach, Marc Baltrun, Adam Neuba, Roland Schoch, Stephan Hohloch, Katja Heinze, Michael Seitz, Oliver Kühn, Stefan Lochbrunner, Matthias Bauer|2021|Chem.Commun.|57|6640|doi:10.1039/D1CC01716K

Space GroupCrystallographyCrystal Systembis[26-bis(1-ethyl-1H-123-triazol-4-yl)pyridine]-iron(ii) bis[hexafluorophosphate] dichloromethane solvateCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1904835: Experimental Crystal Structure Determination

2020

Related Article: Jakob Steube, Lukas Burkhardt, Ayla Päpcke, Johannes Moll, Peter Zimmer, Roland Schoch, Christoph Wölper, Katja Heinze, Stefan Lochbrunner, Matthias Bauer|2019|Chem.-Eur.J.|25|11826|doi:10.1002/chem.201902488

[2-([22'-bipyridin]-6-yl)phenyl]-(22':6'2''-terpyridine)-iron tetraphenylborate dichloromethane solvateSpace GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 2049729: Experimental Crystal Structure Determination

2021

Related Article: Philipp Dierks, Ayla Kruse, Olga S. Bokareva, Mohammed J. Al-Marri, Jens Kalmbach, Marc Baltrun, Adam Neuba, Roland Schoch, Stephan Hohloch, Katja Heinze, Michael Seitz, Oliver Kühn, Stefan Lochbrunner, Matthias Bauer|2021|Chem.Commun.|57|6640|doi:10.1039/D1CC01716K

Space GroupCrystallographybis(44'-(pyridine-26-diyl)bis(1-ethyl-3-methyl-123-triazole-5-ylidene))-iron(ii) bis(hexafluorophosphate) dichloromethane solvateCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1852838: Experimental Crystal Structure Determination

2020

Related Article: Johannnes Moll, Cui Wang, Ayla Päpcke, Christoph Förster, Ute Resch-Genger, Stefan Lochbrunner, Katja Heinze|2020|Chem.-Eur.J.|26|6820|doi:10.1002/chem.202000871

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters[N2N6-dimethyl-N2N6-bis(pyridin-2-yl)pyridine-26-diamine]-[{6-[methyl(pyridin-2-yl)amino]pyridin-2-yl}(pyridin-2-yl)methanone]-ruthenium bis(hexafluorophosphate) acetonitrile solvateExperimental 3D Coordinates
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