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Record W2324125525 · doi:10.1021/ja063030w

New Insight into Reactions of Ni(S<sub>2</sub>C<sub>2</sub>(CF<sub>3</sub>)<sub>2</sub>)<sub>2</sub> with Simple Alkenes:  Alkene Adduct versus Dihydrodithiin Product Selectivity Is Controlled by [Ni(S<sub>2</sub>C<sub>2</sub>(CF<sub>3</sub>)<sub>2</sub>)<sub>2</sub>]<sup>-</sup> Anion

2006· article· en· W2324125525 on OpenAlex
Daniel J. Harrison, Neilson Nguyen, Alan J. Lough, Ulrich Fekl

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.

Bibliographic record

VenueJournal of the American Chemical Society · 2006
Typearticle
Languageen
FieldMaterials Science
TopicOrganic and Molecular Conductors Research
Canadian institutionsUniversity of Toronto
Fundersnot available
KeywordsChemistryAlkeneAdductEthyleneIonSelectivityNickelSulfurStereochemistryCrystallographyPhotochemistryOrganic chemistryCatalysis

Abstract

fetched live from OpenAlex

The nickel bis(dithiolene) complex Ni(S2C2(CF3)2)2 employs its sulfur centers in reactions with alkenes, and stable interligand S-bonded alkene adducts can be formed. The present study shows that the selectivity of alkene binding to charge-neutral Ni(S2C2(CF3)2)2 is influenced by the anion [Ni(S2C2(CF3)2)2]-. In the absence of anion, formation of substituted dihydrodithiins (intraligand addition) dominates, whereas the presence of anion allows for the formation of stable interligand adducts. Mechanistic implications are discussed. The X-ray crystal structure of the ethylene adduct of Ni(S2C2(CF3)2)2 is presented, displaying interligand binding of ethylene to sulfur centers in the bis(dithiolene) complex.

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)0.012
metaresearch head score (Gemma)0.008
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Meta-epidemiology (broad), Science and technology studies, Scholarly communication, Open science, Research integrity, Insufficient payload (model declined to judge)
Consensus categoriesMeta-epidemiology (narrow), Meta-epidemiology (broad), Science and technology studies, Research integrity
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 score0.080
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0120.008
Meta-epidemiology (narrow)0.0110.011
Meta-epidemiology (broad)0.0150.010
Bibliometrics0.0040.017
Science and technology studies0.0070.010
Scholarly communication0.0040.008
Open science0.0110.006
Research integrity0.0060.016
Insufficient payload (model declined to judge)0.0000.001

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 head0.236
Teacher spread0.227 · 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