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Record W2044235309 · doi:10.1021/om000359w

Synthesis and Bonding in the Diamagnetic Dinuclear Tantalum(IV) Hydride Species ([P<sub>2</sub>N<sub>2</sub>]Ta)<sub>2</sub>(μ-H)<sub>4</sub>and the Paramagnetic Cationic Dinuclear Hydride Species {([P<sub>2</sub>N<sub>2</sub>]Ta)<sub>2</sub>(μ-H)<sub>4</sub>}<sup>+</sup>I<sup>-</sup>([P<sub>2</sub>N<sub>2</sub>] = PhP(CH<sub>2</sub>SiMe<sub>2</sub>NSiMe<sub>2</sub>CH<sub>2</sub>)<sub>2</sub>PPh):  The Reducing Ability of a Metal−Metal Bond

2000· article· en· W2044235309 on OpenAlexaff
Michael D. Fryzuk, Samuel A. Johnson, Steven J. Rettig

Bibliographic record

VenueOrganometallics · 2000
Typearticle
Languageen
FieldChemistry
TopicOrganometallic Complex Synthesis and Catalysis
Canadian institutionsUniversity of British Columbia
Fundersnot available
KeywordsChemistryParamagnetismHydrideTantalumDiamagnetismCrystallographyMagnetic susceptibilityDeuteriumHydrogenCarbon monoxideAb initioCationic polymerizationLigand (biochemistry)ReagentInorganic chemistryPhysical chemistryPolymer chemistryCatalysisOrganic chemistryCondensed matter physicsAtomic physics

Abstract

fetched live from OpenAlex

The controlled reaction of the Ta(V) trimethyl species [P 2 N 2 ]TaMe 3, where [P 2 N 2 ] = PhP(CH 2 SiMe 2 NSiMe 2 CH 2 ) 2 PPh, under 0.5 atm of hydrogen gas produces a partially hydrogenated Ta(V) species, ([P 2 N 2 ]TaMe 2 (H), of unknown structure. Under 4 atm of hydrogen gas, further hydrogenation does not produce the complex [P 2 N 2 ]TaH 3; instead, reduction of the tantalum center occurs to yield the dinuclear Ta(IV) hydride ([P 2 N 2 ]Ta) 2 (μ-H) 4 . This diamagnetic tetrahydride fails to react with many reagents, including ethylene and carbon monoxide; however, upon addition of iodomethane, {([P 2 N 2 ]Ta) 2 (μ-H) 4 } + I - is produced as a paramagnetic green crystalline solid. The number of hydrides in this reaction product was confirmed by a deuterium labeling study. The results of a variable-temperature magnetic susceptibility study of this tetrahydride cation can be partially modeled with the Curie−Weiss law and a large correction for temperature-independent magnetism. Ab initio calculations using density functional theory were performed in an attempt to further understand the influence of the macrocyclic ligand in the bonding in these complexes.

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)0.029
metaresearch head score (Gemma)0.017
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMetaresearch, Meta-epidemiology (narrow), Meta-epidemiology (broad), Bibliometrics, Science and technology studies, Scholarly communication, Open science, Research integrity, Insufficient payload (model declined to judge)
Consensus categoriesMeta-epidemiology (narrow), Meta-epidemiology (broad), Bibliometrics, Science and technology studies, Scholarly communication, Open science, Research integrity, Insufficient payload (model declined to judge)
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 score0.092
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0290.017
Meta-epidemiology (narrow)0.0320.032
Meta-epidemiology (broad)0.0320.021
Bibliometrics0.0160.037
Science and technology studies0.0180.028
Scholarly communication0.0150.016
Open science0.0260.016
Research integrity0.0150.028
Insufficient payload (model declined to judge)0.0020.010

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 head0.198
Teacher spread0.188 · 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; both teacher heads agree on what is shown here.

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

Citations48
Published2000
Admission routes1
Has abstractyes

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