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Cibalackrot‐type compounds: Stable singlet fission materials with aromatic ground state and excited state

https://doi.org/10.1002/poc.4441
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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

inferredcites →https://doi.org/10.1002/anie.201704668openalex-snapshot
Intramolecular Singlet Fission in an Antiaromatic Polycyclic Hydrocarbon
inferredcites →https://doi.org/10.1002/chem.201504924openalex-snapshot
Analysis of a Compound Class with Triplet States Stabilized by Potentially Baird Aromatic [10]Annulenyl Dicationic Rings
inferredcites →https://doi.org/10.1002/chem.202005248openalex-snapshot
Prediction of Spin Density, Baird‐Antiaromaticity, and Singlet–Triplet Energy Gap in Triplet‐State Polybenzenoid Systems from Simple Structural Motifs
inferredcites →https://doi.org/10.1002/poc.922openalex-snapshot
Multicenter bond indices as a new measure of aromaticity in polycyclic aromatic hydrocarbons
inferredcites →https://doi.org/10.1021/acs.accounts.0c00601openalex-snapshot
Indolonaphthyridine: A Versatile Chromophore for Organic Electronics Inspired by Natural Indigo Dye
inferredcites →https://doi.org/10.1021/ci00011a011openalex-snapshot
Crystallographic studies of inter- and intramolecular interactions reflected in aromatic character of .pi.-electron systems
inferredcites →https://doi.org/10.1021/cr0300901openalex-snapshot
Anisotropy of the Induced Current Density (ACID), a General Method To Quantify and Visualize Electronic Delocalization
inferredcites →https://doi.org/10.1021/cr300471vopenalex-snapshot
Excited State Aromaticity and Antiaromaticity: Opportunities for Photophysical and Photochemical Rationalizations
inferredcites →https://doi.org/10.1021/ja106594vopenalex-snapshot
Products and Mechanism of Acene Dimerization. A Computational Study
inferredcites →https://doi.org/10.1021/jacs.0c00089openalex-snapshot
Singlet Fission in a Pyrrole-Fused Cross-Conjugated Skeleton with Adaptive Aromaticity
inferredcites →https://doi.org/10.1021/jacs.9b06346openalex-snapshot
Exploiting Excited-State Aromaticity To Design Highly Stable Singlet Fission Materials
inferredcites →https://doi.org/10.1021/jacs.9b12435openalex-snapshot
Strategies for Design of Potential Singlet Fission Chromophores Utilizing a Combination of Ground-State and Excited-State Aromaticity Rules
inferredcites →https://doi.org/10.1021/jo051746oopenalex-snapshot
Nucleus-Independent Chemical Shifts (NICS): Distance Dependence and Revised Criteria for Aromaticity and Antiaromaticity
inferredcites →https://doi.org/10.1038/natrevmats.2017.63openalex-snapshot
Harnessing singlet exciton fission to break the Shockley–Queisser limit
inferredcites →https://doi.org/10.1038/nchem.1518openalex-snapshot
Exciting excited-state aromaticity
inferredcites →https://doi.org/10.1038/nphys3908openalex-snapshot
Strongly exchange-coupled triplet pairs in an organic semiconductor
inferredcites →https://doi.org/10.1038/s41524-022-00860-1openalex-snapshot
Machine-learning assisted design principle search for singlet fission: an example study of cibalackrot
inferredcites →https://doi.org/10.1038/s41586-019-1339-4openalex-snapshot
Sensitization of silicon by singlet exciton fission in tetracene
inferredcites →https://doi.org/10.1039/b813752hopenalex-snapshot
Photostability of pentacene and 6,13-disubstituted pentacene derivatives: a theoretical and experimental mechanistic study
inferredcites →https://doi.org/10.1039/c7cp06114eopenalex-snapshot
The electron density of delocalized bonds (EDDB) applied for quantifying aromaticity
inferredcites →https://doi.org/10.1039/c9ee01508fopenalex-snapshot
Singlet fission molecules among known compounds: finding a few needles in a haystack
inferredcites →https://doi.org/10.1039/c9sc05066copenalex-snapshot
Singlet fission in a hexacene dimer: energetics dictate dynamics
inferredcites →https://doi.org/10.1039/c9tc06581dopenalex-snapshot
A systematic analysis of excitonic properties to seek optimal singlet fission: the BN-substitution patterns in tetracene
inferredcites →https://doi.org/10.1039/d0cs01433hopenalex-snapshot
Unconventional singlet fission materials
inferredcites →https://doi.org/10.1039/d1sc00382hopenalex-snapshot
Excited state character of Cibalackrot-type compounds interpreted in terms of Hückel-aromaticity: a rationale for singlet fission chromophore design
inferredcites →https://doi.org/10.1063/1.1824895openalex-snapshot
The aromatic fluctuation index (FLU): A new aromaticity index based on electron delocalization
inferredcites →https://doi.org/10.1063/1.5121863openalex-snapshot
Structure and photophysics of indigoids for singlet fission: Cibalackrot
inferredcites →https://doi.org/10.1146/annurev-physchem-040412-110130openalex-snapshot
Recent Advances in Singlet Fission

What points at this work

Incoming claims: where this work appears in other papers’ reference lists and arguments.

inferred← citeshttps://doi.org/10.2139/ssrn.4753682openalex-extracted
Quantum Chemical Investigation of Z-Shaped Diradicaloid Heptazethrene Derivatives Towards Linear and Nonlinear Optical Polarizability
inferred← citeshttps://doi.org/10.1002/chem.202203748openalex-snapshot
Photochemistry Driven by Excited‐State Aromaticity Gain or Antiaromaticity Relief
inferred← citeshttps://doi.org/10.1002/cphc.202400271openalex-snapshot
New Perspectives on Delocalization Pathways in Aromatic Molecular Chameleons
inferred← citeshttps://doi.org/10.1002/poc.4468openalex-snapshot
Excited‐state aromaticity and antiaromaticity special issue
inferred← citeshttps://doi.org/10.1002/poc.70000openalex-snapshot
False Identification of (Anti)aromaticity in Polycyclic Molecules in Ground and Excited States Through Incorrect Use of NICS
inferred← citeshttps://doi.org/10.1002/qua.70030openalex-snapshot
Range‐Separated Density Functionals in Predicting Correct Excitation Energies in Gas and Solvent Continuum: A Benchmark Investigation on a Large Set of Molecules
inferred← citeshttps://doi.org/10.1016/j.comptc.2024.114982openalex-snapshot
Molecular design of furanoacene-based singlet fission sensitizers combining diradical character and cross-substitution
inferred← citeshttps://doi.org/10.1016/j.electacta.2023.142498openalex-snapshot
Phenyl-substituted cibalackrot derivatives: Redox behavior, structure-properties relationships and in situ UV-vis/EPR-spectroelectrochemistry of radical ions
inferred← citeshttps://doi.org/10.1016/j.jmgm.2023.108432openalex-snapshot
Quantum chemical investigation of Z-shaped heptazethrenes derivatives with detailed structural parameters and singlet fission for photovoltaic applications
inferred← citeshttps://doi.org/10.1016/j.jmgm.2025.109221openalex-snapshot
Quantum chemical investigation of Z-shaped Diradicaloid heptazethrene derivatives towards linear and nonlinear optical polarizability
inferred← citeshttps://doi.org/10.1021/acs.jctc.3c00125openalex-snapshot
Energy Component Analysis for Electronically Excited States of Molecules: Why the Lowest Excited State Is Not Always the HOMO/LUMO Transition
inferred← citeshttps://doi.org/10.1021/acs.joc.2c02706openalex-snapshot
Phenyl-Substituted Cibalackrot Derivatives: Synthesis, Structure, and Solution Photophysics
inferred← citeshttps://doi.org/10.1021/acs.joc.6c01083openalex-snapshot
Resonance-Structure Collapse Enables Aromaticity-Controlled Design of Small Singlet-Fission Chromophore Candidates
inferred← citeshttps://doi.org/10.1021/acs.jpca.4c08170openalex-snapshot
Diffusion Generative Models for Designing Efficient Singlet Fission Dimers
inferred← citeshttps://doi.org/10.1039/d3qo01498copenalex-snapshot
NO-induced adaptive antiaromaticity in cyclobutadiene
inferred← citeshttps://doi.org/10.1039/d3sc05272aopenalex-snapshot
Dipyrrolonaphthyridinedione – (still) a mysterious cross-conjugated chromophore
inferred← citeshttps://doi.org/10.1039/d4dd00389fopenalex-snapshot
Pursuit of singlet fission fulvene candidates using inverse design
inferred← citeshttps://doi.org/10.1039/d4ra05147eopenalex-snapshot
Aromatic stabilization energies in excited states at the multiconfigurational level: assessment in archetypal organic rings
inferred← citeshttps://doi.org/10.1039/d4sc04692gopenalex-snapshot
Proton transfer induced excited-state aromaticity gain for chromophores with maximal Stokes shifts
inferred← citeshttps://doi.org/10.1039/d5qo01255dopenalex-snapshot
A “sacrificial reagent” strategy for tailoring adaptive aromaticity in pyrrole rings with its application to singlet fission: a combined DFT and unsupervised machine learning study
inferred← citeshttps://doi.org/10.1063/5.0209546openalex-snapshot
Intramolecular singlet fission: Quantum dynamical simulations including the effect of the laser field
inferred← citeshttps://doi.org/10.1111/php.13757openalex-snapshot
Photophysical Insights of Halogenated Dipyrrolonaphthyridine‐Diones as Potential Photodynamic Therapy Agents†
inferred← citeshttps://doi.org/10.1111/php.14096openalex-snapshot
Triplet states nurture the long‐lived emission at room temperature of a chlorine‐containing tetraphenylimidazole derivative when aggregation occurs in water/acetonitrile mixtures
inferred← citeshttps://doi.org/10.2139/ssrn.5383419openalex-snapshot
Quantum Chemical Investigation of Z-Shaped Diradicaloid Heptazethrene Derivatives Towards Linear and Nonlinear Optical Polarizability
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