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Record W2039564669 · doi:10.1021/cg900630a

Development of <i>N,N′</i>-Diaromatic Diimidazolium Cations: Arene Interactions for Highly Organized Crystalline Materials

2009· article· en· W2039564669 on OpenAlex

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

VenueCrystal Growth & Design · 2009
Typearticle
Languageen
FieldChemical Engineering
TopicIonic liquids properties and applications
Canadian institutionsUniversité de Montréal
Fundersnot available
KeywordsStackingDicationAromaticityChemistryMoleculeCrystallographyCrystal engineeringCrystal structureCrystal (programming language)Context (archaeology)Supramolecular chemistryOrganic chemistry

Abstract

fetched live from OpenAlex

We applied concepts developed in the context of molecular recognition of aromatic rings in solution to design molecular tectons capable of generating molecular networks based on aromatic stacking in the crystalline phase. In this respect, N,N′ -diaromatic diimidazolium cations are interesting tectons because they offer electron-rich (aromatic) and electron-poor (imidazolium) rings able to develop aromatic stacking interactions. Two positive charges and six acidic protons divergently oriented on the diimidazolium dication are involved in strong electrostatic charge−charge interactions and H-bonding with anions. Incorporation of aromatic rings modifies the rigidity of these dications. Depending on the flexibility of the molecules, incorporation of water molecules in the crystal lattice is possible, and channels are created in the solid network.

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)0.000
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: none
Teacher disagreement score0.710
Threshold uncertainty score0.761

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 head0.029
GPT teacher head0.250
Teacher spread0.221 · 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