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Record W2093064943 · doi:10.1002/cplu.201300131

An Unexpected Pathway for Ligand Substitution in an Aryl Halide Complex of Palladium

2013· article· en· W2093064943 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.
fundA Canadian funder is recorded on the work.

Bibliographic record

VenueChemPlusChem · 2013
Typearticle
Languageen
FieldChemistry
TopicCatalytic Cross-Coupling Reactions
Canadian institutionsUniversity of Victoria
FundersBritish Columbia Knowledge Development FundNatural Sciences and Engineering Research Council of Canada
KeywordsLigand (biochemistry)IsomerizationSubstitution (logic)PalladiumPhosphineChemistryIodideArylAryl halideSubstitution reactionDenticityHalideCombinatorial chemistryComputer scienceStereochemistryCrystallographyMedicinal chemistryOrganic chemistryCrystal structureCatalysisAlkylProgramming language

Abstract

fetched live from OpenAlex

A supposed spectator ligand plays a crucial role in a seemingly simple ligand substitution reaction on palladium. Continuous monitoring by ESI-MS reveals all the details of an initial fast displacement of iodide by an incoming phosphine ligand, and of the recoordination of iodide that prompts the displacement of the bidentate ligand actually being substituted. An apparent double substitution and subsequent isomerization can be readily explained by two fast and one slow ligand substitution reactions.

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 categoriesnone
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 score0.010
Threshold uncertainty score0.895

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)0.0000.000

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 head0.036
GPT teacher head0.298
Teacher spread0.261 · 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