{"id":"W2897584452","doi":"10.1021/acs.inorgchem.8b02416","title":"Non-Innocent Base Properties of 3- and 4-Pyridyl-dithia- and Diselenadiazolyl Radicals: The Effect of<i>N</i>-Methylation","year":2018,"lang":"en","type":"article","venue":"Inorganic Chemistry","topic":"Organic and Molecular Conductors Research","field":"Materials Science","cited_by":13,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Waterloo","funders":"H2020 Marie Skłodowska-Curie Actions; Horizon 2020 Framework Programme; Université de Bordeaux; Jyväskylän Yliopisto; Centre National de la Recherche Scientifique; European Cooperation in Science and Technology; Natural Sciences and Engineering Research Council of Canada; European Commission; Academy of Finland; Diamond Light Source","keywords":"Chemistry; Radical; Base (topology); Methylation; Medicinal chemistry; Organic chemistry; Photochemistry; Biochemistry","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":[0.0002083822,0.000310182,0.0001770037,0.0001070415,0.0001023597,0.000202651,0.0002434085,0.0002426394,0.001494733],"category_scores_gemma":[0.0002104243,0.0001315752,0.0001158016,0.00008807015,0.000168739,0.0002120335,0.000142338,0.0003122108,0.0002285298],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002109911,"about_ca_system_score_gemma":0.0001908454,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0008096474,"about_ca_topic_score_gemma":0.001398122,"domain_scores_codex":[0.9998938,0.00001430325,0.00001129909,0.00002179481,0.00002888506,0.00002988496],"domain_scores_gemma":[0.9998338,0.00003020499,0.00004287872,0.00001556487,0.00002822824,0.00004922708],"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":[0.0001563839,0.00001402263,0.00005787407,0.00002829064,0.000003469392,0.00001823217,0.00002266967,0.00003558445,0.9989288,0.00004461061,0.00001489307,0.0006751999],"study_design_scores_gemma":[0.00001511774,0.0001943522,0.0004146758,0.000001514954,0.000003802823,0.00002312726,0.000007193355,0.0001250043,0.9988496,0.000006733311,0.0003562104,0.00000250501],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9981678,0.0005364876,0.0003048069,0.00001995518,0.000009469292,0.000011494,0.00009189571,0.00002662568,0.0008314292],"genre_scores_gemma":[0.9980091,0.0003158957,0.000418496,0.00001086602,0.000003756757,0.000006516151,0.0001530363,0.0000116574,0.001070651],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001494733,"threshold_uncertainty_score":0.005000412,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.00948504190728872,"score_gpt":0.2346961078285057,"score_spread":0.225211065921217,"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."}}