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Record W2131494277 · doi:10.1002/ejic.201402440

Mono‐ and Hetero‐Dinuclear Complexes of Janus‐Head NHC Ligands Possessing Backbone Phosphinoyl Groups: the Case of Soft and Hard Metal Centers

2014· article· en· W2131494277 on OpenAlexaff
Paresh Kumar Majhi, Spencer C. Serin, Gregor Schnakenburg, Derek P. Gates, Rainer Streubel

Bibliographic record

VenueEuropean Journal of Inorganic Chemistry · 2014
Typearticle
Languageen
FieldChemistry
TopicN-Heterocyclic Carbenes in Organic and Inorganic Chemistry
Canadian institutionsUniversity of British Columbia
Fundersnot available
KeywordsChemistryDeprotonationDenticityLigand (biochemistry)MetalAdductMedicinal chemistryCarbon monoxideStereochemistryCrystal structureCrystallographyCatalysisOrganic chemistryReceptor

Abstract

fetched live from OpenAlex

Abstract The synthesis and structures of Rh I and Ir I complexes bearing 4‐phosphinoyl‐ and 4,5‐bis(phosphinoyl)imidazol‐2‐ylidene ligands (NHC P ) is reported. Deprotonation of the corresponding imidazolium hydrogen sulfate salts by KO t Bu in the presence of [M(cod)Cl] 2 afforded complexes of the formula [M(cod)Cl(NHC P )] [ 5a/5b : NHC P = 4‐Ph 2 P(O)‐I i PrMe, 5a : M = Rh, 5b : M = Ir and 7a/7b : NHC P = 4,5‐{Ph 2 P(O)} 2 ‐I n BuMe]. The Rh I complexes 5a and 7a were then converted into [Rh(CO) 2 Cl(NHC P )] 8a and 9a via reaction with carbon monoxide; the average CO stretching frequencies [ 8a : $\tilde {\nu}$ (CO) av = 2036 cm –1 and 9a : $\tilde {\nu}$ (CO) av = 2038.4 cm –1 ] led to the conclusion that mono‐ and bis‐functionalized NHC P s act as relatively weaker donors than backbone unsubstituted NHC. A first examination of Janus‐head ligand properties of complex 7a revealed that reaction with TiCl 4 afforded hetero‐dinuclear 10a , a′ as a mixture of isomeric monodentate phosphinoyl titanium(IV) adducts. All products were characterized by elemental analyses, spectroscopic and spectrometric methods and, in addition, complexes 7a and 7b by single‐crystal X‐ray structure analysis.

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)0.001
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow)
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 score0.019
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.000
Science and technology studies0.0000.001
Scholarly communication0.0000.000
Open science0.0010.000
Research integrity0.0000.001
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 head0.011
GPT teacher head0.217
Teacher spread0.206 · 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

Citations18
Published2014
Admission routes1
Has abstractyes

Explore more

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