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Record W2800937713 · doi:10.1002/chem.201801139

Enantiopure Phospha[1]ferrocenophanes: Textbook Examples of Through‐Space Nuclear Spin–Spin Coupling

2018· article· en· W2800937713 on OpenAlex
Saeid Sadeh, My P. T. Cao, J. Wilson Quail, Jianfeng Zhu, Jens Müller

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".

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.
fundA Canadian funder is recorded on the work.

Bibliographic record

VenueChemistry - A European Journal · 2018
Typearticle
Languageen
FieldChemistry
TopicFerrocene Chemistry and Applications
Canadian institutionsCrosslight Software (Canada)University of Saskatchewan
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsEnantiopure drugChemistryMoietyMetathesisIsopropylChirality (physics)CrystallographyCoupling (piping)FerroceneStereochemistryMedicinal chemistryOrganic chemistryMaterials scienceChiral symmetryEnantioselective synthesisPhysicsQuantum mechanicsPhysical chemistryCatalysis

Abstract

fetched live from OpenAlex

Abstract Three enantiopure phospha[1]ferrocenophanes ( 2 R ) equipped with either a phenyl, an isopropyl, or a tert ‐butyl group at the bridging phosphorus atom were synthesized by a salt‐metathesis approach in isolated yields between 52 and 63 %. The chirality in these strained sandwich compounds stems from the planar‐chiral ferrocene moiety, which is symmetrically equipped with two i Pr groups adjacent to phosphorus. Surprisingly, all three phospha[1]ferrocenophanes show an uncommon through‐space nuclear 1 H– 31 P coupling. As a result of the embedded symmetry, these new compounds are ideal examples to differentiate between through‐space and through‐bond coupling mechanisms in NMR spectroscopy.

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 categoriesMeta-epidemiology (narrow), Insufficient 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 score0.124
Threshold uncertainty score1.000

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 studies0.0010.001
Scholarly communication0.0000.000
Open science0.0010.000
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0070.000

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 head0.022
GPT teacher head0.255
Teacher spread0.234 · 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