{"id":"W4404124938","doi":"10.1021/jacs.4c09796","title":"A Spontaneous Magnetic Moment in an Organic Radical: Synthesis and Characterization of Benzodioxepinyl-1,3,2-dithiazolyl","year":2024,"lang":"en","type":"article","venue":"Journal of the American Chemical Society","topic":"Magnetism in coordination complexes","field":"Materials Science","cited_by":3,"is_retracted":false,"has_abstract":true,"ca_institutions":"Brock University; University of Windsor","funders":"Agencia Estatal de Investigación; Natural Sciences and Engineering Research Council of Canada; Canada Research Chairs","keywords":"Chemistry; Characterization (materials science); Moment (physics); Computational chemistry; Nuclear magnetic resonance; Organic chemistry; Nanotechnology; Quantum mechanics","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":"codex-gemma-dda1882f352a","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0004925341,0.0001141907,0.0003262801,0.00004138367,0.00003349977,0.00006802339,0.0003663193,0.00004171169,0.0004065635],"category_scores_gemma":[0.0001151268,0.00008006,0.0001296729,0.0004008854,0.0004319987,0.000149843,0.000111969,0.0002098455,0.000002325597],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001340514,"about_ca_system_score_gemma":0.00008592161,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001744795,"about_ca_topic_score_gemma":0.000001598234,"domain_scores_codex":[0.9986828,0.0001125974,0.0004830989,0.0001710143,0.0003845867,0.0001658811],"domain_scores_gemma":[0.999069,0.0002488183,0.0003574374,0.0001701238,0.00007212986,0.00008250966],"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":[0.00003086396,0.00006729667,0.0002874102,0.00005522143,0.000008526905,0.00001721726,0.0004871974,0.000002740747,0.9919294,0.00003814542,0.000146795,0.006929248],"study_design_scores_gemma":[0.0001976789,0.0002462696,0.01353879,0.0002117468,0.00006439108,0.0006920688,0.000198323,0.002267832,0.9811459,0.0003396237,0.0009376088,0.0001597814],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9967347,0.000207977,0.0002482556,0.002493719,0.0001875127,0.00008636919,0.00001434573,0.00001579391,0.00001136352],"genre_scores_gemma":[0.9971798,0.0001519196,0.002269124,0.0002188949,0.0001349143,0.000003882809,7.022766e-7,0.00001590731,0.00002487107],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01325138,"threshold_uncertainty_score":0.4451585,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008527170810804528,"score_gpt":0.2371827091188586,"score_spread":0.2286555383080541,"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."}}