{"id":"W3086798158","doi":"10.1002/cctc.202001382","title":"Mechanistic Insights into Fe Catalyzed α‐C−H Oxidations of Tertiary Amines","year":2020,"lang":"en","type":"article","venue":"ChemCatChem","topic":"Metal-Catalyzed Oxygenation Mechanisms","field":"Chemistry","cited_by":7,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université du Québec à Montréal","funders":"","keywords":"Chemistry; Catalysis; Electron paramagnetic resonance; Kinetic isotope effect; Selectivity; Amine gas treating; Kinetics; Reaction mechanism; Substrate (aquarium); Isotopic labeling; Combinatorial chemistry; Photochemistry; Radical; Hydrolysis; Organic chemistry","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":false},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.00008203612,0.0003022315,0.000415416,0.00007714181,0.0001014258,0.00003011803,0.0005764414,0.0001956561,0.001364424],"category_scores_gemma":[0.0005239681,0.0003024651,0.0001604144,0.000442055,0.0000853967,0.0001901693,0.000211913,0.0002105571,0.0002765974],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00006867894,"about_ca_system_score_gemma":0.00009180899,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00004530609,"about_ca_topic_score_gemma":0.00001182922,"domain_scores_codex":[0.9981603,0.00001911586,0.0006078018,0.0005336404,0.0004224623,0.0002566765],"domain_scores_gemma":[0.9984435,0.0001084355,0.0003097738,0.0006333541,0.0002137188,0.0002912467],"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":[0.00001808061,0.00008545239,0.00003708353,0.0004111642,0.00007501081,0.000007925783,0.002199424,0.000002772555,0.9934677,0.002118382,0.0005406907,0.001036277],"study_design_scores_gemma":[0.0005949721,0.000009468682,0.00003092417,0.00003367895,0.00008667568,0.000004367227,0.0006303983,0.0009789261,0.992282,0.003243603,0.001799302,0.00030573],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9858434,0.0003468298,0.008191625,0.001222962,0.0001205874,0.0001602477,0.00004345994,0.0003003531,0.003770594],"genre_scores_gemma":[0.9924634,0.000026284,0.005706044,0.0002992983,0.0002143776,0.00006168547,0.0006965225,0.0000609868,0.0004714787],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.006619981,"threshold_uncertainty_score":0.9999427,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02059595807841896,"score_gpt":0.2373963390975683,"score_spread":0.2168003810191493,"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."}}