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Record W2052901032 · doi:10.1139/v03-016

Photocycloaddition of cyclohex-2-enones to acrylonitrile

2003· article· en· W2052901032 on OpenAlexvenueno aff
Lars Meyer, Nacira Alouane, Kerstin Schmidt, Paul Margaretha

Bibliographic record

VenueCanadian Journal of Chemistry · 2003
Typearticle
Languageen
FieldChemistry
TopicRadical Photochemical Reactions
Canadian institutionsnot available
Fundersnot available
KeywordsChemistryAcrylonitrileRegioselectivityMethacrylonitrilePhotochemistryCyclobutaneAlkeneEnoneDiastereomerCycloadditionMedicinal chemistryOrganic chemistryRing (chemistry)

Abstract

fetched live from OpenAlex

The photocycloaddition of cyclohex-2-enones 1a, 1b, and 5a–5c to acrylonitrile (2) in benzene has been studied. The reactions proceed with moderate regioselectivity and with preferential formation of diastereomeric mixtures of endo- and exo-5-oxobicyclo[4.2.0]octane-7-carbonitriles 3, 4, and 6–8. Very similar relative rates of conversion to products are observed in the photocycloadditions of 1b, 5a, and 5b to 2 and methacrylonitrile (9), respectively. In contrast, 5,5-dimethylcyclohex-2-enone (1b) forms cycloadducts with 2,3-dimethylbut-2-ene (12) as efficiently as with the unsaturated nitriles, but the 2,5,5-trialkylcyclohex-2-enones 5a and 5b do not react with this alkene at measurable rates of conversion. A dual path mechanism is presented that involves either exciplex formation between triplet-excited cyclohexenones and electron-rich alkenes or radical addition of the former to electron-deficient alkenes bearing a substituent, exercising a resonance effect.Key words: [2+2]-photocycloaddition, cyclobutane, cyclobutanecarbonitrile, radical addition to unsaturated nitriles.

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)0.000
metaresearch head score (Gemma)0.001
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesInsufficient 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 score0.114
Threshold uncertainty score0.991

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.001
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)0.0100.000

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 head0.008
GPT teacher head0.216
Teacher spread0.208 · 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

Citations5
Published2003
Admission routes1
Has abstractyes

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