{"id":"W2326372338","doi":"10.1021/om201122q","title":"Stoichiometric Reactivity Relevant to the Mor-DalPhos/Pd-Catalyzed Cross-Coupling of Ammonia and 1-Bromo-2-(phenylethynyl)benzene","year":2012,"lang":"en","type":"article","venue":"Organometallics","topic":"Catalytic Cross-Coupling Reactions","field":"Chemistry","cited_by":14,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Alberta; Dalhousie University","funders":"Natural Sciences and Engineering Research Council of Canada; Dalhousie University","keywords":"Chemistry; Catalysis; Benzene; Alkyne; Ammonia; Medicinal chemistry; Reactivity (psychology); Aryl; Ligand (biochemistry); Stoichiometry; Amination; Diphenylacetylene; Substrate (aquarium); Palladium; Stereochemistry; Organic chemistry","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":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.001030276,0.0004374192,0.0006081786,0.0003896612,0.0004182742,0.0002118095,0.0005965088,0.0002568439,0.0003996978],"category_scores_gemma":[0.001666489,0.0003655958,0.0002072016,0.002076248,0.0003263122,0.0004900867,0.0005178765,0.0005827888,0.0001677011],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002620667,"about_ca_system_score_gemma":0.0001144809,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005106545,"about_ca_topic_score_gemma":0.00006547631,"domain_scores_codex":[0.9972209,0.000002492995,0.0007153113,0.0006006652,0.0006513138,0.0008092982],"domain_scores_gemma":[0.9966858,0.0007692126,0.0004258596,0.001467337,0.0002410965,0.0004106947],"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":[0.00007258216,0.0004052508,0.03830926,0.0001464846,0.0001668369,0.000003293684,0.0008229025,0.0001487991,0.9566993,0.0002237392,0.00008261773,0.00291897],"study_design_scores_gemma":[0.001138008,0.00002966845,0.09191598,0.0000592663,0.0002918218,0.0001074738,0.0004156285,0.0005955055,0.8890597,0.00008935439,0.0156391,0.000658459],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9967709,0.001194742,0.0002322841,0.000326491,0.0003816076,0.0002604866,0.000159272,0.0001539649,0.0005203055],"genre_scores_gemma":[0.9974646,0.0001674404,0.0004109837,0.00004932403,0.0004834358,0.00004289242,0.00007528341,0.0001182452,0.001187768],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.06763952,"threshold_uncertainty_score":0.9998796,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02031107303211389,"score_gpt":0.2838848893369461,"score_spread":0.2635738163048322,"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."}}