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Record W2333656143 · doi:10.1021/om201233e

Thermal Rearrangement via P–C Bond Cleavage of a Tridentate Diphosphine–N-Heterocyclic Carbene Ligand System Coordinated to Rhodium

2012· article· en· W2333656143 on OpenAlexaff
Bryan K. Shaw, Brian O. Patrick, Michael D. Fryzuk

Bibliographic record

VenueOrganometallics · 2012
Typearticle
Languageen
FieldChemistry
TopicN-Heterocyclic Carbenes in Organic and Inorganic Chemistry
Canadian institutionsUniversity of British Columbia
Fundersnot available
KeywordsChemistryRhodiumCarbenePhosphineIntramolecular forceLigand (biochemistry)Bond cleavageStereochemistryArylReactivity (psychology)Thermal decompositionMedicinal chemistryCatalysisOrganic chemistryAlkyl

Abstract

fetched live from OpenAlex

The synthesis of a series of rhodium complexes, [PCP]RhX, where X = Cl, H, CH 3 and PCP is a tridentate ligand that contains a central, saturated NHC donor flanked by two o -phenylenediisopropylphosphino groups, is described. These complexes were characterized by NMR spectroscopy ( 1 H, 13 C, and 31 P) and, in the case of the X = Cl derivative, by X-ray crystallography. Investigation of the thermal reactivity of these complexes uncovered an unexpected ligand rearrangement process (for X = H, CH 3 ) resulting from intramolecular P–C bond cleavage between one of the phosphine donors and the aryl linker of the ligand backbone. The structures of the P–C activation products are confirmed through X-ray diffraction analysis, and preliminary rate data in the case of the rhodium hydride are presented.

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)0.000
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 score0.026
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0010.001
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.001
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0010.001
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.000

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 head0.009
GPT teacher head0.223
Teacher spread0.214 · 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

Citations43
Published2012
Admission routes1
Has abstractyes

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