{"id":"W2210360830","doi":"10.1107/s1600536809016468","title":"2,6-Bis(trifluoromethyl)benzoic acid","year":2009,"lang":"en","type":"article","venue":"Acta Crystallographica Section E Structure Reports Online","topic":"Crystal structures of chemical compounds","field":"Chemistry","cited_by":4,"is_retracted":false,"has_abstract":true,"ca_institutions":"Saint Mary's University","funders":"","keywords":"Trifluoromethyl; Benzoic acid; Chemistry; Medicinal chemistry; 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001197872,0.0003413818,0.0003210721,0.0002108169,0.0002555806,0.0001726715,0.0003619022,0.0002746953,0.008382767],"category_scores_gemma":[0.0001224006,0.0001202199,0.0001241373,0.0002080532,0.0001249735,0.000232919,0.0001678725,0.0002816004,0.004645502],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003026146,"about_ca_system_score_gemma":0.0003108315,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001254927,"about_ca_topic_score_gemma":0.001573151,"domain_scores_codex":[0.9998592,0.00001394826,0.000005556232,0.00002642436,0.00003606402,0.00005872713],"domain_scores_gemma":[0.9999582,0.00000225138,0.00001082906,0.000004220935,0.000008707688,0.0000158758],"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":[0.0003986072,0.00008019432,0.0001573071,0.0002023171,0.000007885783,0.0001422894,0.00001417213,0.0002548989,0.9840958,0.0008589982,0.001627768,0.0121597],"study_design_scores_gemma":[0.0001414657,0.001730304,0.002397427,0.00003012846,0.00002007004,0.0006583047,0.00001899117,0.0006324832,0.9101126,0.0001694205,0.08406033,0.00002840935],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.831987,0.01741862,0.03078468,0.001443024,0.001479517,0.0005119352,0.004795392,0.003433472,0.1081464],"genre_scores_gemma":[0.9494483,0.006176077,0.009374436,0.0002561579,0.0001280605,0.0001081515,0.001542888,0.00009056502,0.0328754],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.008382767,"threshold_uncertainty_score":0.02804315,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006653339744815667,"score_gpt":0.2387946420520352,"score_spread":0.2321413023072196,"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."}}