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Record W1532646253 · doi:10.1002/ejic.201402687

A Copper Complex of a Noninnocent Iminophenol‐Amidopyridine Hybrid Ligand: Synthesis, Characterization, and Aerobic Alcohol Oxidation

2014· article· en· W1532646253 on OpenAlexaff
Zahra Alaji, Elham Safaei, Linus Chiang, Ryan M. Clarke, Changhua Mu, Tim Storr

Bibliographic record

VenueEuropean Journal of Inorganic Chemistry · 2014
Typearticle
Languageen
FieldChemistry
TopicMetal-Catalyzed Oxygenation Mechanisms
Canadian institutionsSimon Fraser University
Fundersnot available
KeywordsChemistryElectron paramagnetic resonanceCopperLigand (biochemistry)PhotochemistryRedoxAmideAlcohol oxidationImineDensity functional theoryRadicalCrystallographyInorganic chemistryAlcoholCatalysisOrganic chemistryComputational chemistryNuclear magnetic resonance

Abstract

fetched live from OpenAlex

Abstract Reaction of the noninnocent iminophenol‐iminopyridine hybrid ligand HL IPIP , where L IPIP denotes [2‐(( E )‐{( E )‐2‐[( E )‐pyridin‐2‐ylmethyleneamino]benzylidene}amino)‐4,6‐di‐ tert ‐butylphenolate], with copper acetate afforded a copper complex, L APIP Cu II , in which one of the imine functional groups is oxidized to an amide during metal complexation. The new Cu II complex is capable of catalyzing efficient aerobic alcohol oxidation under mild conditions. The crystal structure of L APIP Cu II exhibits a square‐planar geometry with the Cu II center coordinated by three nitrogen atoms and one oxygen atom. Electrochemical studies were conducted to evaluate the redox‐active behavior of the complex, and the results showed a quasireversible reduction and a ligand‐based oxidation process. The neutral species of L APIP Cu II is EPR active, which is consistent with a paramagnetic electronic ground state (d 9 , S = 1/2), whereas the one‐electron oxidized complex was X‐band EPR silent. One‐electron chemical oxidation of L APIP Cu II gave a new species that can be attributed to a Cu II ‐phenoxyl radical complex. Based on EPR measurements in conjunction with density functional theory calculations, [L APIP Cu II ] + is proposed to have a triplet electronic ground state, exhibiting a weak ferromagnetic interaction between the Cu II center and the coordinated phenoxyl radical.

Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.

How this classification was reachedexpand

Full frame distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.001
metaresearch head score (Gemma)0.001
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Insufficient payload (model declined to judge)
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.003
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.001
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0020.000

Machine scores (provisional)

The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.

Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.

Opus teacher head0.016
GPT teacher head0.212
Teacher spread0.196 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one teacher head, not a consensus.

Study designBench or experimental
Domainnot available
GenreEmpirical

How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".

Quick stats

Citations44
Published2014
Admission routes1
Has abstractyes

Explore more

Same venueEuropean Journal of Inorganic ChemistrySame topicMetal-Catalyzed Oxygenation MechanismsFrench-language works237,207