{"id":"W2761212930","doi":"10.3390/m962","title":"1,3-Bis(2,6-diisopropylphenyl)-2-trichloromethylimidazolidine","year":2017,"lang":"en","type":"article","venue":"Molbank","topic":"N-Heterocyclic Carbenes in Organic and Inorganic Chemistry","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"ca_institutions":"Saint Mary's University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Carbene; Chloroform; Chemistry; Adduct; Single crystal; Density functional theory; Carbon-13 NMR; Elemental analysis; Crystal structure; Proton NMR; Crystallography; Nuclear magnetic resonance spectroscopy; Stereochemistry; Computational chemistry; Organic chemistry; Catalysis","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":[0.0001709983,0.0003468992,0.0002840163,0.0001552486,0.0001460828,0.000195696,0.0005793024,0.0002096525,0.001890104],"category_scores_gemma":[0.000108805,0.0001103253,0.0001286078,0.0001761741,0.0001828156,0.0001845074,0.000239688,0.0003254402,0.0004812947],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003832748,"about_ca_system_score_gemma":0.000258817,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000892167,"about_ca_topic_score_gemma":0.001762396,"domain_scores_codex":[0.9998864,0.00001376957,0.000006751553,0.00003229727,0.00003346884,0.00002723981],"domain_scores_gemma":[0.9999373,0.000009102841,0.00002171895,0.00000759013,0.000007658522,0.0000166436],"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":[0.00009296816,0.0000178701,0.0001095831,0.0001107708,0.000005750845,0.00009775806,0.00001939822,0.0001075179,0.9965672,0.0004188491,0.0001020081,0.002350248],"study_design_scores_gemma":[0.00004846601,0.0003545481,0.001027769,0.00000466316,0.00001150797,0.0002672794,0.00001160551,0.0005025265,0.9920834,0.00002550041,0.005653852,0.000008873047],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9627492,0.003623904,0.01899177,0.0002069288,0.00009282989,0.0001366217,0.0007307854,0.0004364441,0.01303149],"genre_scores_gemma":[0.9893264,0.0011965,0.005474374,0.00005138728,0.00001316223,0.00005064176,0.000424034,0.00003140187,0.003432046],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001890104,"threshold_uncertainty_score":0.00632298,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01684014424415322,"score_gpt":0.2638920367559225,"score_spread":0.2470518925117693,"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."}}