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Record W2038847116 · doi:10.1021/om100334r

Divergent Reactivity of Perfluoropentaphenylborole with Alkynes

2010· article· en· W2038847116 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.

Bibliographic record

VenueOrganometallics · 2010
Typearticle
Languageen
FieldChemistry
TopicOrganoboron and organosilicon chemistry
Canadian institutionsUniversity of AlbertaUniversity of Calgary
Fundersnot available
KeywordsDiphenylacetyleneChemistryPericyclic reactionAlkyneAdductRing (chemistry)BoraneReactivity (psychology)Medicinal chemistryPyridineStereochemistryOrganic chemistryCatalysis

Abstract

fetched live from OpenAlex

The reactions of perfluoropentaphenylborole ( 1 ) with the symmetrical internal alkynes RCCR (R = C 6 F 5, C 6 H 5, CH 2 CH 3 ) have been explored. For R = C 6 F 5, a slow reaction occurs via a Diels−Alder pathway established for the non-fluorinated system to give the new borane perfluoroheptaphenylborepin 2 . The new perfluoroarylborane 2 and its pyridine adduct 2-py were characterized crystallographically. In contrast, the reaction of 1 with diphenylacetylene is dominated by a reaction path in which the borole electrophilically attacks the alkyne, triggering a 1,2 phenyl migration and borole ring expansion to deliver the boracyclohexadiene 3 as the major product. Minor products in this reaction were identified as diphenyl-substituted borepins resulting from the Diels−Alder reaction channel. Finally, 3-hexyne reacts with 1 via the Diels−Alder pathway, but the kinetic products are not the expected diethyl borepins but rather one of the initial Diels−Alder adducts formed prior to ring-opening to the seven-membered borepin ring. This intermediate was fully characterized and provides concrete evidence for the pericyclic reaction sequence proposed by Eisch for the reaction of pentaphenylborole with diphenylacetylene.

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.

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)0.000
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 score0.038
Threshold uncertainty score0.979

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
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)0.0220.000

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 head0.007
GPT teacher head0.206
Teacher spread0.199 · 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