{"id":"W4401353114","doi":"10.1021/acs.langmuir.4c01446","title":"Energetics and Redox Kinetics of Pure Ferrocene-Terminated <i>N</i>-Heterocyclic Carbene Self-Assembled Monolayers on Gold","year":2024,"lang":"en","type":"article","venue":"Langmuir","topic":"Molecular Junctions and Nanostructures","field":"Engineering","cited_by":7,"is_retracted":false,"has_abstract":true,"ca_institutions":"Queen's University; University of Calgary","funders":"Social Sciences and Humanities Research Council of Canada; Canadian Institutes of Health Research; Canada Foundation for Innovation; Alberta Innovates; University of Calgary; Natural Sciences and Engineering Research Council of Canada; Queen's University; Canada First Research Excellence Fund; Canada Research Chairs; Innovation for Defence Excellence and Security","keywords":"Monolayer; Ferrocene; Chemistry; Carbene; Oxidizing agent; Redox; Self-assembled monolayer; Kinetics; Homogeneous; Crystallography; Molecule; Energetics; Stereochemistry; Photochemistry; Polymer chemistry; Electrochemistry; Inorganic chemistry; Organic chemistry; Physical chemistry; Catalysis; Electrode","routes":{"ca_aff":true,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001939457,0.0002628461,0.000243467,0.0002263435,0.0002070963,0.0003761467,0.0003992592,0.0003891978,0.0008291431],"category_scores_gemma":[0.0003096747,0.0002092379,0.000179007,0.000148419,0.0002192724,0.0003380213,0.0001596413,0.0002679315,0.0002123307],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0005443242,"about_ca_system_score_gemma":0.0001246762,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001369508,"about_ca_topic_score_gemma":0.001729694,"domain_scores_codex":[0.9998364,0.00001873777,0.00001077311,0.00003928172,0.00005710804,0.000037696],"domain_scores_gemma":[0.999877,0.00005211967,0.00002130607,0.000008918562,0.0000263051,0.00001428511],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"bench_or_experimental","study_design_scores_codex":[0.0001441889,0.00002641674,0.00076679,0.00007641329,0.00001855642,0.00008534311,0.00007722942,0.001061017,0.9958895,0.0002257662,0.00005207306,0.001576678],"study_design_scores_gemma":[0.00001010194,0.0001393374,0.003429238,0.000005807904,0.00001264877,0.00005361859,0.00007016029,0.01095406,0.9848287,0.00008250433,0.0004025354,0.00001125724],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9985412,0.0002822383,0.0004766231,0.00001859995,0.000005067611,0.000005583262,0.00006245261,0.00001606725,0.0005921121],"genre_scores_gemma":[0.9986423,0.0001852507,0.0005580309,0.00001232537,0.000002604228,0.000008891831,0.0001074294,0.000008914587,0.0004742946],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001369508,"threshold_uncertainty_score":0.003949344,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.004207583138186212,"score_gpt":0.1999753272019245,"score_spread":0.1957677440637383,"validation_status":"score_only:v0-immature-baseline","note":"Baseline scores from an immature model (maturity gate not passed). Scores rank; they never assert a category."}}