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Record W4410131515 · doi:10.26434/chemrxiv-2025-5l1bd

N-Heterocyclic Carbenes Excel at Functionalizing Diverse Carbon Surfaces with Robust Organic Monolayers

2025· preprint· en· W4410131515 on OpenAlexafffund
Milad Shamsi, Robert M. Mayall, Fereshteh Vajhadin, Sara Masood Cheema, Dianne Lee, Ahmadreza Nezamzadeh, Andrea Martínez, Jialang Li, Vinay Saini, Philip Egberts, Justin Lomax, Paul J. Ragogna, Justin L. MacCallum, Cathleen M. Crudden, Viola Birss

Bibliographic record

VenueChemRxiv · 2025
Typepreprint
Languageen
FieldChemistry
TopicN-Heterocyclic Carbenes in Organic and Inorganic Chemistry
Canadian institutionsWestern UniversityQueen's UniversityUniversity of Calgary
FundersSocial Sciences and Humanities Research Council of CanadaNatural Sciences and Engineering Research Council of CanadaQueen's UniversityCanada Research ChairsUniversity of CalgaryAlberta InnovatesCape Breton University
KeywordsMonolayerCarbon fibersTotal organic carbonChemistryNanotechnologyMaterials scienceCombinatorial chemistryOrganic chemistryComposite material

Abstract

fetched live from OpenAlex

The controlled deposition of organic monolayers on carbon substrates is a well-known challenge, with existing methods yielding partial coverages or non-uniform, uncontrollable multilayers. N-heterocyclic carbenes (NHCs) have recently been shown to form stable self-assembled monolayers (SAMs) on a range of metals. Here, we demonstrate that NHCs with diverse alkylated backbones and a variety of terminal groups can also be reliably deposited as uniform layers at up to monolayer coverages on a wide range of carbon surfaces, including planar carbons and highly surface-defective carbon powders. Tunable surface coverages, strong support for NHC chemisorption, and excellent electrochemical and thermal stability of these monolayers is observed, comparable to NHC or alkylthiol SAMs on metals. We showcase one application of NHCs on carbon, demonstrating an impedimetric sensor for bacterial biomarker detection, achieving performances associated with metal-supported SAMs. This work positions NHCs as transformative tools for carbon surface modification, enabling applications previously restricted only to metal-supported SAMs.

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 score0.003

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)0.0010.000

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 head0.019
GPT teacher head0.223
Teacher spread0.204 · 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

Citations1
Published2025
Admission routes2
Has abstractyes

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Same venueChemRxivSame topicN-Heterocyclic Carbenes in Organic and Inorganic ChemistryFrench-language works237,207