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Record W4360828137 · doi:10.1021/acs.chemmater.2c03429

Synthesis and Characterization of a Monodentate N-Heterocyclic Carbene-Protected Au<sub>11</sub>-Nanocluster via Reduction with KC<sub>8</sub>

2023· article· en· W4360828137 on OpenAlexafffund
Angus I. Sullivan, Joseph F. DeJesus, Sami Malola, Shinjiro Takano, Tatsuya Tsukuda, Hannu Häkkinen, Cathleen M. Crudden

Bibliographic record

VenueChemistry of Materials · 2023
Typearticle
Languageen
FieldMaterials Science
TopicNanocluster Synthesis and Applications
Canadian institutionsQueen's University
FundersCore Research for Evolutional Science and TechnologySocial Sciences and Humanities Research Council of CanadaNatural Sciences and Engineering Research Council of CanadaQueen's UniversityOntario Research FoundationCanada Foundation for InnovationAcademy of FinlandJapan Society for the Promotion of ScienceOntario Ministry of Research, Innovation and ScienceGovernment of Ontario
KeywordsNanoclustersDenticityCarbeneSodium borohydrideCluster (spacecraft)ChemistryNanomaterialsCrystal structureCharacterization (materials science)CrystallographyNanotechnologyMaterials scienceCombinatorial chemistryOrganic chemistryCatalysis

Abstract

fetched live from OpenAlex

Atomically precise gold nanoclusters are an exciting and growing class of nanomaterials. While normally protected with ligands such as thiols or phosphines, gold nanoclusters protected with N-heterocyclic carbenes (NHCs) have recently garnered attention due to potential improvements in stability and optical properties of the resulting clusters. However, as this field is in its infancy, little work has been done with reducing agents beyond sodium borohydride (NaBH 4 ), a reagent that dominated synthetic efforts in other clusters as well. Herein, we report the use of potassium intercalated graphite (KC 8 ) in the synthesis of nanoclusters, and the novel Au 11 -nanocluster protected with monodentate NHC ligands it produces, [Au 11 (NHC) 8 Br 2 ]Br. The cluster is characterized by ESI-MS, UV–vis spectroscopy, 1 H and 13 C{ 1 H} NMR. Starting from a partially resolved X-ray crystal structure showing the heavy atoms, DFT calculations enable us to propose a total structure.

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)
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 score0.003
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
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 head0.010
GPT teacher head0.209
Teacher spread0.199 · 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.

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

Citations8
Published2023
Admission routes2
Has abstractyes

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