Search results for "Diradical"

showing 10 items of 37 documents

Dibenzocycloheptatriene as end-group of Thiele and tetrabenzo-Chichibabin hydrocarbons

2020

The authors are grateful for the financial support from: MICIU/FEDER/AEI, Spain (PG2018-101181-B-I00, PGC2018-095808B-I00, MAT2016-80826-R, FIP-2018-HECTIC-PTM, Prometeo2019/076 and the "Severo Ochoa" Programme for Centres of Excellence in R & D; SEV-2015-0496), the European Research Council (ERC) (677023), DGR (Catalunya) (2017-SGR-918), and SNSF (Switzerland, TS., PZ00P2_174175). We thank the CSIRC-Alhambra and SciCore (Basel, Switzerland) for supercomputing facilities and the Servei de RMN, UAB, for instrument time.

SingletAggregation-induced emissionPolycyclic aromatic hydrocarbon010402 general chemistry01 natural sciencesCatalysisClosed-shellComputational chemistryMaterials ChemistrySinglet stateAggregation-induced emissionOpen shellchemistry.chemical_classification010405 organic chemistryChemistryDiradicalMetals and AlloysGeneral Chemistry3. Good health0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic MaterialsEnd-groupTerminal (electronics)Ceramics and CompositesPolycyclic aromatic-hydrocarbon
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CCDC 286386: Experimental Crystal Structure Determination

2006

Related Article: N.Roques, P.Gerbier, U.Schatzschneider, J.-P.Sutter, P.Guionneau, J.Vidal-Gancedo, J.Veciana, E.Rentschler, C.Guerin|2006|Chem.-Eur.J.|12|5547|doi:10.1002/chem.200501280

Space GroupCrystallography25-bis(4-(N-t-Butyl-N-oxylamino)phenyl)thiophene diradicalCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 780832: Experimental Crystal Structure Determination

2011

Related Article: J.Konu, T.Chivers, H.M.Tuononen|2010|Chem.-Eur.J.|16|12977|doi:10.1002/chem.201001699

Space GroupCrystallographyCrystal System(((bis(Diphenylphosphorothioyl)methyl)disulfanyl) (bis(diphenylphosphorothioyl))methanide diradical anion-SS')-(12-bis(dimethylamino)ethane-NN')-lithium dichloromethane solvateCrystal StructureCell ParametersExperimental 3D Coordinates
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CCDC 1862544: Experimental Crystal Structure Determination

2019

Related Article: Kubandiran Kolanji, Lars Postulka, Bernd Wolf, Michael Lang, Dieter Schollmeyer, and Martin Baumgarten|2019|J.Org.Chem.|84|140|doi:10.1021/acs.joc.8b02499

Space GroupCrystallographyCrystal SystemCrystal Structure22'-(48-dimethoxybenzo[12-b:45-b']bis(thiene-26-diyl))bis(4455-tetramethyl-45-dihydro-1H-imidazol-1-olate) diradicalCell ParametersExperimental 3D Coordinates
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CCDC 1862543: Experimental Crystal Structure Determination

2019

Related Article: Kubandiran Kolanji, Lars Postulka, Bernd Wolf, Michael Lang, Dieter Schollmeyer, and Martin Baumgarten|2019|J.Org.Chem.|84|140|doi:10.1021/acs.joc.8b02499

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters22'-(48-dimethoxybenzo[12-b:45-b']bisthiene-26-diyl)bis(4455-tetramethyl-3-oxo-45-dihydro-1H-3lambda5-imidazol-1-olate) diradicalExperimental 3D Coordinates
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CCDC 1862545: Experimental Crystal Structure Determination

2019

Related Article: Kubandiran Kolanji, Lars Postulka, Bernd Wolf, Michael Lang, Dieter Schollmeyer, and Martin Baumgarten|2019|J.Org.Chem.|84|140|doi:10.1021/acs.joc.8b02499

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters22'-[(48-dimethoxybenzo[12-b:45-b']bisthiene-26-diyl)bis(thiene-52-diyl)]bis(4455-tetramethyl-45-dihydro-1H-3lambda5-imidazole-13-diolate) diradicalExperimental 3D Coordinates
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CCDC 1922230: Experimental Crystal Structure Determination

2020

Related Article: E. M. Kadilenko, N. P. Gritsan, E. V. Tretyakov, S. V. Fokin, G. V. Romanenko, A. S. Bogomyakov, D. E. Gorbunov, D. Schollmeyer, M. Baumgarten, V. I. Ovcharenko|2020|Dalton Trans.|49|16916|doi:10.1039/D0DT03184D

Space GroupCrystallographyCrystal SystemCrystal StructureCell ParametersExperimental 3D Coordinatesbis(mu-2-[(hydroxyimino)(4455-tetramethyl-1-oxyl-imidazol-2-yl)methyl]-4455-tetramethyl-3-oxo-imidazol-1-oxyl diradical)-bis(111555-hexafluoroacetylacetonato)-bis(trifluoroacetato)-di-nickel(ii)
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CCDC 1988288: Experimental Crystal Structure Determination

2020

Related Article: E. M. Kadilenko, N. P. Gritsan, E. V. Tretyakov, S. V. Fokin, G. V. Romanenko, A. S. Bogomyakov, D. E. Gorbunov, D. Schollmeyer, M. Baumgarten, V. I. Ovcharenko|2020|Dalton Trans.|49|16916|doi:10.1039/D0DT03184D

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parameters[22'-{[t-butyl(oxo)-azanylidene]methylene}bis(4455-tetramethyl-3-oxo-imidazol-1-oxyl) diradical]-bis(111555-hexafluoroacetylacetonato)-manganese(ii) dichloromethane solvateExperimental 3D Coordinates
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CCDC 1988287: Experimental Crystal Structure Determination

2020

Related Article: E. M. Kadilenko, N. P. Gritsan, E. V. Tretyakov, S. V. Fokin, G. V. Romanenko, A. S. Bogomyakov, D. E. Gorbunov, D. Schollmeyer, M. Baumgarten, V. I. Ovcharenko|2020|Dalton Trans.|49|16916|doi:10.1039/D0DT03184D

Space GroupCrystallographyCrystal SystemCrystal StructureCell Parametersbis(mu-2-[(hydroxyimino)(4455-tetramethyl-1-oxyl-imidazol-2-yl)methyl]-4455-tetramethyl-3-oxo-imidazol-1-oxyl diradical)-bis(111555-hexafluoroacetylacetonato)-bis(trifluoroacetato)-di-manganese(ii) toluene solvateExperimental 3D Coordinates
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CCDC 1922229: Experimental Crystal Structure Determination

2020

Related Article: E. M. Kadilenko, N. P. Gritsan, E. V. Tretyakov, S. V. Fokin, G. V. Romanenko, A. S. Bogomyakov, D. E. Gorbunov, D. Schollmeyer, M. Baumgarten, V. I. Ovcharenko|2020|Dalton Trans.|49|16916|doi:10.1039/D0DT03184D

Space GroupCrystallographyCrystal SystemCrystal Structurebis(mu-2-[(hydroxyimino)(4455-tetramethyl-1-oxyl-imidazol-2-yl)methyl]-4455-tetramethyl-3-oxo-imidazol-1-oxyl diradical)-bis(111555-hexafluoroacetylacetonato)-bis(trifluoroacetato)-di-manganese(ii) bis(mu-22'-(hydroxycarbonimidoyl)bis(4455-tetramethyl-3-oxo-imidazol-1-oxyl) diradical)-bis(111555-hexafluoroacetylacetonato)-bis(trifluoroacetato)-di-manganese(ii) toluene solvateCell ParametersExperimental 3D Coordinates
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