On the public citation graph

Triplet State Baird Aromaticity in Macrocycles: Scope, Limitations, and Complications

https://doi.org/10.1021/acs.jpca.0c08926
0 signed · 128 inferred · view as graph

Inferred edges come from two machine sources: sweeps of open repository metadata (mostly SSRN and Zenodo), and a bulk OpenAlex citation snapshot. Every row below is labelled with the one it came from. Neither is a complete citation index — absence here is not evidence of absence.

Is this your work? Sign in with ORCID and put your name on the claims that are yours.
Claim with ORCID
Reference health. See whether every reference in this work resolves to a known work and none has been retracted — and get a dated CiteStamped badge you can embed.
See reference health

What this work says

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

inferredcites →https://doi.org/10.1002/(sici)1521-3773(19980803)37:13/14<1945::aid-anie1945>3.0.co;2-eopenalex-snapshot
Consequences of Triplet Aromaticity in 4nπ-Electron Annulenes: Calculation of Magnetic Shieldings for Open-Shell Species
inferredcites →https://doi.org/10.1002/anie.199626641openalex-snapshot
Cyclic [6]‐ and [8]Paraphenylacetylenes
inferredcites →https://doi.org/10.1002/anie.200454188openalex-snapshot
Aromaticity: The Alternating CC Bond Length Structures of [14]‐, [18]‐, and [22]Annulene
inferredcites →https://doi.org/10.1002/anie.201501887openalex-snapshot
A Practicable Real‐Space Measure and Visualization of Static Electron‐Correlation Effects
inferredcites →https://doi.org/10.1002/anie.201602083openalex-snapshot
Aromaticity Reversal in the Lowest Excited Triplet State of Archetypical Möbius Heteroannulenic Systems
inferredcites →https://doi.org/10.1002/anie.201603631openalex-snapshot
A Description of Vibrational Modes in Hexaphyrins: Understanding the Aromaticity Reversal in the Lowest Triplet State
inferredcites →https://doi.org/10.1002/anie.201611431openalex-snapshot
The Extension of Baird's Rule to Twisted Heteroannulenes: Aromaticity Reversal of Singly and Doubly Twisted Molecular Systems in the Lowest Triplet State
inferredcites →https://doi.org/10.1002/anie.201700063openalex-snapshot
Möbius Aromatic [28]Hexaphyrin Germanium(IV) and Tin(IV) Complexes: Efficient Formation of Triplet Excited States
inferredcites →https://doi.org/10.1002/anie.201906069openalex-snapshot
The Supramolecular Chemistry of Strained Carbon Nanohoops
inferredcites →https://doi.org/10.1002/anie.201913058openalex-snapshot
Excited‐State Aromaticity of Gold(III) Hexaphyrins and Metalation Effect Investigated by Time‐Resolved Electronic and Vibrational Spectroscopy
inferredcites →https://doi.org/10.1002/anie.202006066openalex-snapshot
Ultrafast Exciton Self‐Trapping and Delocalization in Cycloparaphenylenes: The Role of Excited‐State Symmetry in Electron‐Vibrational Coupling
inferredcites →https://doi.org/10.1002/anie.202007024openalex-snapshot
Conjugated Nanohoops Incorporating Donor, Acceptor, Hetero‐ or Polycyclic Aromatics
inferredcites →https://doi.org/10.1002/asia.201600582openalex-snapshot
Size Dependence of [ n ]Cycloparaphenylenes ( n =5–12) in Electrochemical Oxidation
inferredcites →https://doi.org/10.1002/asia.202000528openalex-snapshot
Achieving Adaptive Aromaticity in Cyclo[10]carbon by Screening Cyclo[n]carbon (n=8−24)
inferredcites →https://doi.org/10.1002/chem.200900322openalex-snapshot
Double Aromaticity and Ring Currents in All‐Carbon Rings
inferredcites →https://doi.org/10.1002/chem.201701404openalex-snapshot
Cyclopropyl Group: An Excited‐State Aromaticity Indicator?
inferredcites →https://doi.org/10.1002/cplu.201800307openalex-snapshot
Molecular Photoswitching Aided by Excited‐State Aromaticity
inferredcites →https://doi.org/10.1002/ejoc.201301810openalex-snapshot
Evaluation of Triplet Aromaticity by the Indene–Isoindene Isomerization Stabilization Energy Method
inferredcites →https://doi.org/10.1002/jcc.21759openalex-snapshot
Effect of the damping function in dispersion corrected density functional theory
inferredcites →https://doi.org/10.1002/jcc.22885openalex-snapshot
Multiwfn: A multifunctional wavefunction analyzer
inferredcites →https://doi.org/10.1002/jcc.24805openalex-snapshot
The role of the long‐range exchange corrections in the description of electron delocalization in aromatic species
inferredcites →https://doi.org/10.1002/jcc.25074openalex-snapshot
Relevance of the DFT method to study expanded porphyrins with different topologies
inferredcites →https://doi.org/10.1002/slct.201602080openalex-snapshot
Aromaticity, the Hückel 4 n+2 Rule and Magnetic Current
inferredcites →https://doi.org/10.1002/wcms.1327openalex-snapshot
Software update: the ORCA program system, version 4.0
inferredcites →https://doi.org/10.1007/bf01112569openalex-snapshot
Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions
inferredcites →https://doi.org/10.1007/s00214-007-0310-xopenalex-snapshot
The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals
inferredcites →https://doi.org/10.1007/s11224-011-9883-zopenalex-snapshot
Aromaticity in heterocycles: new HOMA index parametrization
inferredcites →https://doi.org/10.1016/j.chempr.2017.09.005openalex-snapshot
Unraveling Excited-Singlet-State Aromaticity via Vibrational Analysis
inferredcites →https://doi.org/10.1016/j.cplett.2004.06.011openalex-snapshot
A new hybrid exchange–correlation functional using the Coulomb-attenuating method (CAM-B3LYP)
inferredcites →https://doi.org/10.1016/j.cplett.2009.10.089openalex-snapshot
Double aromaticity and ring currents in open-shell systems
inferredcites →https://doi.org/10.1021/acs.accounts.7b00629openalex-snapshot
Spectroscopic Diagnosis of Excited-State Aromaticity: Capturing Electronic Structures and Conformations upon Aromaticity Reversal
inferredcites →https://doi.org/10.1021/acs.accounts.9b00257openalex-snapshot
Global Aromaticity in Macrocyclic Polyradicaloids: Hückel’s Rule or Baird’s Rule?
inferredcites →https://doi.org/10.1021/acs.jctc.0c00297openalex-snapshot
Performance of Localized Coupled Cluster Methods in a Moderately Strong Correlation Regime: Huckel–Mobius Interconversions in Expanded Porphyrins
inferredcites →https://doi.org/10.1021/acs.jctc.5b00359openalex-snapshot
Is It Possible To Obtain Coupled Cluster Quality Energies at near Density Functional Theory Cost? Domain-Based Local Pair Natural Orbital Coupled Cluster vs Modern Density Functional Theory
inferredcites →https://doi.org/10.1021/acs.jctc.9b00532openalex-snapshot
OpenMolcas: From Source Code to Insight
inferredcites →https://doi.org/10.1021/acs.joc.6b02460openalex-snapshot
Magnetic Shielding, Aromaticity, Antiaromaticity, and Bonding in the Low-Lying Electronic States of Benzene and Cyclobutadiene
inferredcites →https://doi.org/10.1021/acs.joc.7b00906openalex-snapshot
Can Baird’s and Clar’s Rules Combined Explain Triplet State Energies of Polycyclic Conjugated Hydrocarbons with Fused 4 n π- and (4 n + 2)π-Rings?
inferredcites →https://doi.org/10.1021/acs.joc.7b03030openalex-snapshot
Macrocyclic Oligofurans: A Computational Study
inferredcites →https://doi.org/10.1021/acs.jpca.5b06027openalex-snapshot
Study of Electron Delocalization in 1,2-, 1,3-, and 1,4-Azaborines Based on the Canonical Molecular Orbital Contributions to the Induced Magnetic Field and Polyelectron Population Analysis
inferredcites →https://doi.org/10.1021/acs.jpca.8b03105openalex-snapshot
Near-Infrared Fluorescence from In-Plane-Aromatic Cycloparaphenylene Dications
inferredcites →https://doi.org/10.1021/acs.jpca.8b05041openalex-snapshot
Quantification of Aromaticity of Heterocyclic Systems Using Interaction Coordinates
inferredcites →https://doi.org/10.1021/acs.jpcc.0c01559openalex-snapshot
When are Antiaromatic Molecules Paramagnetic?
inferredcites →https://doi.org/10.1021/acs.jpclett.0c02261openalex-snapshot
Disentangling the Contributions to the Proton Magnetic Shielding in Carbon Nanohoops and Nanobelts: Evidence for a Paratropic Belt-Current
inferredcites →https://doi.org/10.1021/acs.jpclett.9b00623openalex-snapshot
Aromaticity and Antiaromaticity in the Excited States of Porphyrin Nanorings
inferredcites →https://doi.org/10.1021/acs.jpclett.9b02815openalex-snapshot
Cyclo[18]carbon: Insight into Electronic Structure, Aromaticity, and Surface Coupling
inferredcites →https://doi.org/10.1021/ar5004253openalex-snapshot
Syntheses of the Smallest Carbon Nanohoops and the Emergence of Unique Physical Phenomena
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/cr990326uopenalex-snapshot
Structural Aspects of Aromaticity
inferredcites →https://doi.org/10.1021/j100096a001openalex-snapshot
Ab Initio Calculation of Vibrational Absorption and Circular Dichroism Spectra Using Density Functional Force Fields
inferredcites →https://doi.org/10.1021/ja00179a005openalex-snapshot
Efficient implementation of the gauge-independent atomic orbital method for NMR chemical shift calculations
inferredcites →https://doi.org/10.1021/ja00769a025openalex-snapshot
Quantum organic photochemistry. II. Resonance and aromaticity in the lowest 3.pi..pi.* state of cyclic hydrocarbons
inferredcites →https://doi.org/10.1021/ja511320fopenalex-snapshot
In-Plane Aromaticity in Cycloparaphenylene Dications: A Magnetic Circular Dichroism and Theoretical Study
inferredcites →https://doi.org/10.1021/ja960582dopenalex-snapshot
Nucleus-Independent Chemical Shifts: A Simple and Efficient Aromaticity Probe
inferredcites →https://doi.org/10.1021/jacs.0c05033openalex-snapshot
Synthesis of Cyclo[18]carbon via Debromination of C18Br6
inferredcites →https://doi.org/10.1021/jacs.0c06007openalex-snapshot
A Nonalternant Aromatic Belt: Methylene-Bridged [6]Cycloparaphenylene Synthesized from Pillar[6]arene
inferredcites →https://doi.org/10.1021/jacs.5b04047openalex-snapshot
Switching between Aromatic and Antiaromatic 1,3-Phenylene-Strapped [26]- and [28]Hexaphyrins upon Passage to the Singlet Excited State
inferredcites →https://doi.org/10.1021/jacs.5b04511openalex-snapshot
Transient EPR Reveals Triplet State Delocalization in a Series of Cyclic and Linear π-Conjugated Porphyrin Oligomers
inferredcites →https://doi.org/10.1021/jacs.7b05386openalex-snapshot
Electronic Delocalization in the Radical Cations of Porphyrin Oligomer Molecular Wires
inferredcites →https://doi.org/10.1021/jacs.7b08021openalex-snapshot
Structural Monitoring of the Onset of Excited-State Aromaticity in a Liquid Crystal Phase
inferredcites →https://doi.org/10.1021/jo100902wopenalex-snapshot
Magnetically Induced Currents in [ n ]Cycloparaphenylenes, n = 6−11
inferredcites →https://doi.org/10.1021/jo101371mopenalex-snapshot
DFT Study of Cycloparaphenylenes and Heteroatom-Substituted Nanohoops
inferredcites →https://doi.org/10.1021/jp0034426openalex-snapshot
Delocalization of Electrons in Molecules
inferredcites →https://doi.org/10.1021/jp304681hopenalex-snapshot
Macrocyclic Aromaticity of Porphyrin Units in Fully Conjugated Oligoporphyrins
inferredcites →https://doi.org/10.1021/jp310480dopenalex-snapshot
Validity and Limitations of the Bridged Annulene Model for Porphyrins
inferredcites →https://doi.org/10.1021/jp4016678openalex-snapshot
Analytical Study of Superaromaticity in Cycloarenes and Related Coronoid Hydrocarbons
inferredcites →https://doi.org/10.1021/jp406932mopenalex-snapshot
Superaromatic Stabilization Energy as a Novel Local Aromaticity Index for Polycyclic Aromatic Hydrocarbons
inferredcites →https://doi.org/10.1021/jp8037335openalex-snapshot
Ground- and Excited-State Aromaticity and Antiaromaticity in Benzene and Cyclobutadiene
inferredcites →https://doi.org/10.1021/jp8067365openalex-snapshot
Aromaticity and Antiaromaticity in the Low-Lying Electronic States of Cyclooctatetraene
inferredcites →https://doi.org/10.1021/jp9831029openalex-snapshot
Two-State Model of Antiaromaticity: The Low Lying Singlet States
inferredcites →https://doi.org/10.1021/jp9831031openalex-snapshot
Two-State Model of Antiaromaticity: The Triplet State. Is Hund's Rule Violated?
inferredcites →https://doi.org/10.1021/ol0261332openalex-snapshot
Recommendations for the Evaluation of Aromatic Stabilization Energies
inferredcites →https://doi.org/10.1021/ol0529546openalex-snapshot
Which NICS Aromaticity Index for Planar π Rings Is Best?
inferredcites →https://doi.org/10.1021/ol400908zopenalex-snapshot
Evaluation of Triplet Aromaticity by the Isomerization Stabilization Energy
inferredcites →https://doi.org/10.1038/nchem.1518openalex-snapshot
Exciting excited-state aromaticity
inferredcites →https://doi.org/10.1038/nchem.1888openalex-snapshot
Efficient room-temperature synthesis of a highly strained carbon nanohoop fragment of buckminsterfullerene
inferredcites →https://doi.org/10.1038/nchem.2233openalex-snapshot
Reversal of Hückel (anti)aromaticity in the lowest triplet states of hexaphyrins and spectroscopic evidence for Baird's rule
inferredcites →https://doi.org/10.1038/nchem.2242openalex-snapshot
A light-switched yin and yang pair
inferredcites →https://doi.org/10.1038/nchem.2834openalex-snapshot
Bicyclic Baird-type aromaticity
inferredcites →https://doi.org/10.1038/s41467-017-00382-1openalex-snapshot
Energetics of Baird aromaticity supported by inversion of photoexcited chiral [4n]annulene derivatives
inferredcites →https://doi.org/10.1039/b108253copenalex-snapshot
Synthesis and characterization of [46]paracyclophanedodecayne derivative
inferredcites →https://doi.org/10.1039/b901621jopenalex-snapshot
Macrocyclic aromaticity in Hückel and Möbius conformers of porphyrinoids
inferredcites →https://doi.org/10.1039/b910521bopenalex-snapshot
Prediction of the main macrocyclic conjugation pathway for porphyrinoids from the ring current distribution
inferredcites →https://doi.org/10.1039/c39850001207openalex-snapshot
Evidence for the generation of aromatic cationic systems in the excited state. Photochemical solvolysis of fluoren-9-ol
inferredcites →https://doi.org/10.1039/c5cp01782copenalex-snapshot
Singlet and triplet excitons and charge polarons in cycloparaphenylenes: a density functional theory study
inferredcites →https://doi.org/10.1039/c5cp07170dopenalex-snapshot
Can the current density map topology be extracted from the nucleus independent chemical shifts?
inferredcites →https://doi.org/10.1039/c5cs00114eopenalex-snapshot
Magnetic criteria of aromaticity
inferredcites →https://doi.org/10.1039/c5cs00143aopenalex-snapshot
The dynamic, size-dependent properties of [5]–[12]cycloparaphenylenes
inferredcites →https://doi.org/10.1039/c6sc00765aopenalex-snapshot
The Raman fingerprint of cyclic conjugation: the case of the stabilization of cations and dications in cycloparaphenylenes
inferredcites →https://doi.org/10.1039/c7cp07581bopenalex-snapshot
New electron delocalization tools to describe the aromaticity in porphyrinoids
inferredcites →https://doi.org/10.1039/c7tc02336gopenalex-snapshot
1,4-Azaborine as a controller of triplet energy, exciton distribution, and aromaticity in [6]cycloparaphenylenes
inferredcites →https://doi.org/10.1039/c8cc03693dopenalex-snapshot
Highly strained [6]cycloparaphenylene: crystallization of an unsolvated polymorph and the first mono- and dianions
inferredcites →https://doi.org/10.1039/c8cp03112fopenalex-snapshot
Bicycloaromaticity and Baird-type bicycloaromaticity of dithienothiophene-bridged [34]octaphyrins
inferredcites →https://doi.org/10.1039/c8cp04860fopenalex-snapshot
Significant structural relaxations of excited [ n ]cycloparaphenylene dications ( n = 5–9)
inferredcites →https://doi.org/10.1039/c9sc03247aopenalex-snapshot
A macrocyclic oligofuran: synthesis, solid state structure and electronic properties
inferredcites →https://doi.org/10.1039/d0cp01252aopenalex-snapshot
Induced magnetic field in sp-hybridized carbon rings: analysis of double aromaticity and antiaromaticity in cyclo[2 N ]carbon allotropes
inferredcites →https://doi.org/10.1039/d0sc03072dopenalex-snapshot
Structural deformation and host–guest properties of doubly-reduced cycloparaphenylenes, [ n ]CPPs 2− ( n = 6, 8, 10, and 12)
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/10.1063/1.2180774openalex-snapshot
Assessing a new nonempirical density functional: Difficulties in treating π-conjugation effects
inferredcites →https://doi.org/10.1063/1.2222352openalex-snapshot
Erratum: “The aromatic fluctuation index (FLU): A new aromaticity index based on electron delocalization” [J. Chem Phys. 122, 014109 (2005)]
inferredcites →https://doi.org/10.1063/1.3382344openalex-snapshot
A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
inferredcites →https://doi.org/10.1063/1.438955openalex-snapshot
Self-consistent molecular orbital methods. XX. A basis set for correlated wave functions
inferredcites →https://doi.org/10.1063/1.443164openalex-snapshot
A full coupled-cluster singles and doubles model: The inclusion of disconnected triples
inferredcites →https://doi.org/10.1063/1.453520openalex-snapshot
Quadratic configuration interaction. A general technique for determining electron correlation energies
inferredcites →https://doi.org/10.1063/1.462209openalex-snapshot
Second-order perturbation theory with a complete active space self-consistent field reference function
inferredcites →https://doi.org/10.1063/1.464913openalex-snapshot
Density-functional thermochemistry. III. The role of exact exchange
inferredcites →https://doi.org/10.1063/1.4773581openalex-snapshot
An efficient and near linear scaling pair natural orbital based local coupled cluster method
inferredcites →https://doi.org/10.1063/1.4821834openalex-snapshot
Natural triple excitations in local coupled cluster calculations with pair natural orbitals
inferredcites →https://doi.org/10.1126/science.aay1914openalex-snapshot
An sp-hybridized molecular carbon allotrope, cyclo[18]carbon
inferredcites →https://doi.org/10.1246/bcsj.20160237openalex-snapshot
Graph Theory of Aromatic Stabilization
inferredcites →https://doi.org/10.1246/bcsj.51.1788openalex-snapshot
Aromaticity-Based Theory of Pericyclic Reactions
inferredcites →https://doi.org/10.3390/molecules25030711openalex-snapshot
How do the Hückel and Baird Rules Fade away in Annulenes?

What points at this work

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

inferred← citeshttps://doi.org/10.12688/openreseurope.19690.1zenodo-depositor-declared
Concealed antiaromaticity
inferred← citeshttps://doi.org/10.1002/chem.202103536openalex-snapshot
Ring Size Determines the Conformation, Global Aromaticity and Photophysical Properties of Macrocyclic Oligofurans
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/chem.202300477openalex-snapshot
Design, Synthesis and Aromaticity of an Alternating Cyclo[4]Thiophene[4]Furan
inferred← citeshttps://doi.org/10.1002/ejoc.202100352openalex-snapshot
Visualisation of Chemical Shielding Tensors (VIST) to Elucidate Aromaticity and Antiaromaticity**
inferred← citeshttps://doi.org/10.1002/ejoc.202201008openalex-snapshot
Quantifying Vertical Resonance Energy in Aromatic Systems with Natural Bond Orbitals
inferred← citeshttps://doi.org/10.1002/poc.70035openalex-snapshot
Aromaticity and Photoreactivity of 4‐ and 3‐Nitrenopyridine 1‐Oxides and Phenylnitrene
inferred← citeshttps://doi.org/10.1007/s12039-023-02230-wopenalex-snapshot
Peripheral (anti)aromaticity in the singlet and triplet states of cyclopenta[fg]acenaphthylene, pyrrolo[2,1,5-cd]indolizine and 2a1 boracyclopenta[cd]indene: NICS scan approach
inferred← citeshttps://doi.org/10.1016/j.cplett.2024.141742openalex-snapshot
First excited singlet state aromaticity of macroheterocycles
inferred← citeshttps://doi.org/10.1021/acs.jpclett.3c01808openalex-snapshot
Stable Diradical on the Dimethyldihydropyrene Scaffold
inferred← citeshttps://doi.org/10.1021/jacs.1c00476openalex-snapshot
meso-Oxoisocorroles: Tunable Antiaromaticity by Metalation and Coordination of Lewis Acids as Well as Aromaticity Reversal in the Triplet Excited State
inferred← citeshttps://doi.org/10.1039/d3cc05225gopenalex-snapshot
π-Conjugated oligofuran macrocycles
inferred← citeshttps://doi.org/10.1039/d3cp01994bopenalex-snapshot
Charge delocalization and aromaticity of doubly reduced double-walled carbon nanohoops
inferred← citeshttps://doi.org/10.26434/chemrxiv-2024-6pxt4openalex-snapshot
π-System Bistability Determines the Circularly Polarized Luminescence in Helicene para-Phenylenes
inferred← citeshttps://doi.org/10.3390/chemistry7040127openalex-snapshot
Aromaticity and Antiaromaticity: How to Define Them
Editorial review for independent work. ICSAC — the Institute for Complexity Science and Advanced Computing — runs a structured editorial panel for researchers publishing outside journals, and publishes on CiteStamp rails. Submission is free and goes through ORCID: icsacinstitute.org/submit.