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Record W2068418986 · doi:10.1021/om0601706

A Structural Probe for Organogold(I) Rings and [2]Catenanes

2006· article· en· W2068418986 on OpenAlexaff
N.C. Habermehl, D.J. Eisler, Christopher W. Kirby, N.L.S. Yue, Richard J. Puddephatt

Bibliographic record

VenueOrganometallics · 2006
Typearticle
Languageen
FieldChemistry
TopicMolecular Sensors and Ion Detection
Canadian institutionsWestern University
Fundersnot available
KeywordsCatenaneChemistryRing (chemistry)CyclohexaneStereochemistryCrystallographyNMR spectra databaseMoleculeSpectral lineOrganic chemistryPhysics

Abstract

fetched live from OpenAlex

The digold(I) diacetylides [4-RC 6 H 9 (4-C 6 H 4 OCH 2 C⋮CAu) 2 ], which contain a cyclohexylidene hinge group 4-RC 6 H 9 with R = H or t -Bu, react with diphosphine ligands Ph 2 PZPPh 2 to give the corresponding macrocycles or [2]catenanes [{4-RC 6 H 9 (4-C 6 H 4 OCH 2 C⋮CAu) 2 (μ-Ph 2 PZPPh 2 )} y ] [Z = C⋮C, (CH 2 ) 2, (CH 2 ) 3, or (CH 2 ) 4; y = 1, 2, or 4]. When R = t -Bu, the bulky tert -butyl group locks the cyclohexane ring conformation and so provides a good NMR spectroscopic probe of the structure. The organogold(I) [2]catenane complexes are chiral when R = t -Bu, and the complex with Z = (CH 2 ) 4 gives an equilibrium in solution between ring, double-ring, and [2]catenane. When R = H and Z = (CH 2 ) 3, the variable-temperature NMR spectra give new insight into the fluxionality in the [2]catenane complex, and when R = H and Z = (CH 2 ) 4, it is shown that the complex exists in solution as the ring structure, although it crystallizes as a doubly braided [2]catenane.

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 categoriesnone
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 score0.064
Threshold uncertainty score0.506

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
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)0.0000.000

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 head0.007
GPT teacher head0.196
Teacher spread0.189 · 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.

The models applied no category: nothing in the taxonomy fit this work.
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

Citations54
Published2006
Admission routes1
Has abstractyes

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