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Record W2313901310 · doi:10.1021/ic101883u

Comparison of Structure and Reactivity of Phosphine-Amido and Hemilabile Phosphine-Amine Chelates of Rhodium

2011· article· en· W2313901310 on OpenAlexaff
Lindsay J. Hounjet, Robert McDonald, Michael J. Ferguson, Martín Cowie

Bibliographic record

VenueInorganic Chemistry · 2011
Typearticle
Languageen
FieldChemistry
TopicAsymmetric Hydrogenation and Catalysis
Canadian institutionsUniversity of Alberta
Fundersnot available
KeywordsChemistryRhodiumPhosphineDeprotonationMedicinal chemistryReactivity (psychology)Amine gas treatingMethoxideChelationStereochemistryCatalysisOrganic chemistryIon

Abstract

fetched live from OpenAlex

A series of mono- and binuclear rhodium(I) complexes bearing ortho-phosphinoanilido and ortho-phosphinoaniline ligands has been synthesized. Reactions of the protic monophosphinoanilines, Ph(2)PAr or PhPAr(2) (Ar = o-C(6)H(4)NHMe), with 0.5 equiv of [Rh(μ-OMe)(COD)](2) result in the formation of the neutral amido complexes, [Rh(COD)(P,N-Ph(2)PAr(-))] or [Rh(COD)(P,N-PhP(Ar(-))Ar)] (Ar(-) = o-C(6)H(4)NMe(-)), respectively, through stoichiometrically controlled deprotonation of an amine by the internal methoxide ion. Similarly, the binuclear complex, [Rh(2)(COD)(2)(μ-P,N,P',N'-mapm(2-))] (mapm(2-) = Ar(Ar(-))PCH(2)P(Ar(-))Ar), can be prepared by reaction of the protic diphosphinoaniline, mapm (Ar(2)PCH(2)PAr(2)), with 1 equiv of [Rh(μ-OMe)(COD)](2). An analogous series of hemilabile phosphine-amine compounds can be generated by reactions of monophosphinoanilines, Ph(2)PAr' or PhPAr'(2) (Ar' = o-C(6)H(4)NMe(2)), with 1 equiv of [Rh(NBD)(2)][BF(4)] to generate [Rh(NBD)(P,N-Ph(2)PAr')][BF(4)] or [Rh(NBD)(P,N-PhPAr'(2))][BF(4)], respectively, or by reactions of diphosphinoanilines, mapm or dmapm (Ar'(2)PCH(2)PAr'(2)), with 2 equiv of the rhodium precursor to generate [Rh(2)(NBD)(2)(μ-P,N,P',N'-mapm)][BF(4)](2) or [Rh(2)(NBD)(2)(μ-P,N,P',N'-dmapm)][BF(4)](2), respectively. Displacement of the diolefin from [Rh(COD)(P,N-Ph(2)PAr(-))] by 1,2-bis(diphenylphosphino)ethane (dppe) yields [Rh(P,P'-dppe)(P,N-Ph(2)PAr(-))] which, while unreactive to H(2), reacts readily and irreversibly with oxygen to form the peroxo complex, [RhO(2)(P,P'-dppe)(P,N-Ph(2)PAr(-))], and with iodomethane to yield [RhI(CH(3))(P,P'-dppe)(P,N-Ph(2)PAr(-))]. Hemilabile phosphine-amine compounds can also be prepared by reactions of [Rh(P,P'-dppe)(P,N-Ph(2)PAr(-))] with Me(3)OBF(4) or HBF(4)·Et(2)O, resulting in (thermodynamic) additions at nitrogen to form [Rh(P,P'-dppe)(P,N-Ph(2)PAr')][BF(4)] or [Rh(P,P'-dppe)(P,N-Ph(2)PAr)][BF(4)], respectively. The nonlabile phosphine-amido and hemilabile phosphine-amine complexes were tested as catalysts for the silylation of styrene. The amido species do not require the use of solvents in reaction media, can be easily removed from product mixtures by protonation, and appear to be more active than their hemilabile, cationic congeners. Reactions catalyzed by either amido or amine complexes favor dehydrogenative silylation in the presence of excess olefin, showing modest selectivities for a single vinylsilane product. The binuclear complexes, which were prepared in an effort to explore possible catalytic enhancements of reactivity due to metal-metal cooperativity, are in fact somewhat less active than mononuclear species, discounting this possibility.

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 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 score0.103
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
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 head0.014
GPT teacher head0.240
Teacher spread0.226 · 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

Citations20
Published2011
Admission routes1
Has abstractyes

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