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Record W4385276377 · doi:10.26434/chemrxiv-2023-ptghf

Polyaromatic phosphetenes: versatile platforms for circularly polarized luminescence generation through chiral perturba-tion

2023· preprint· en· W4385276377 on OpenAlexfundno aff
Hortense Lauwick, Kristóf Noel Garami, Wimonsiri Huadsai, Matthew P. Duffy, Roukayaati Foundi, Thierry Roisnel, Nicolas Vanthuyne, Zoltán Benkő, Pierre‐Antoine Bouit, Muriel Hissler

Bibliographic record

VenueChemRxiv · 2023
Typepreprint
Languageen
FieldChemistry
TopicSynthesis and characterization of novel inorganic/organometallic compounds
Canadian institutionsnot available
FundersInstitute of Circulatory and Respiratory HealthRégion BretagneUniversité de Rennes 1Campus FranceCentre National de la Recherche ScientifiqueMinistère de l'Enseignement supérieur, de la Recherche et de l'Innovation
KeywordsStereocenterRing (chemistry)LuminescenceHOMO/LUMOAtomic orbitalChemistryStereochemistryCrystallographyMaterials sciencePhysicsMoleculeEnantioselective synthesisOrganic chemistryOptoelectronics

Abstract

fetched live from OpenAlex

We describe the synthesis of four new polyaromatic fluoro-phores fused to a phosphetene ring (4-membered P-ring). These compounds are fully characterized including X-ray diffraction. Due to the presence of the stereogenic P-atom, all compounds are found as racemic mixture, which could be separated by chiral separation. The impact of both the poly-aromatic platform and the P-ring on the structure, the optical and redox properties are investigated both experimentally and theoretically. Although neither the P centre nor the 4-membered ring significantly takes part in HOMO or LUMO orbitals, both of these structural features have an important modulating role in distorting the symmetry of the orbitals, leading to chiroptical properties. In this case, the stereogenic P-atom is used as chiral perturbator to induce circularly po-larized luminescence of the polyaromatic system

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 machine prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation 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 score0.001
Threshold uncertainty score0.005

Distilled classifier scores by category (both heads)

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)0.0010.001

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 head0.075
GPT teacher head0.267
Teacher spread0.192 · 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 source (direct Gemma or distilled Codex), 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

Citations0
Published2023
Admission routes1
Has abstractyes

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