{"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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0003290053,0.0004365298,0.0003097677,0.0001875746,0.0001661021,0.0002820196,0.000465278,0.0003929094,0.001556129],"category_scores_gemma":[0.0004504118,0.0002497006,0.0001164898,0.0002675142,0.0001670226,0.0003363825,0.0002519848,0.000462767,0.0004460738],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003630664,"about_ca_system_score_gemma":0.0002296766,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001018204,"about_ca_topic_score_gemma":0.002149216,"domain_scores_codex":[0.9996251,0.0000654282,0.00003827656,0.00008523833,0.0001161724,0.00006982887],"domain_scores_gemma":[0.9998844,0.00002998774,0.00002817835,0.00001376107,0.00002428176,0.00001946299],"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":[0.0001520411,0.00003669793,0.0003188877,0.0001093035,0.00001130471,0.0000971634,0.00004353114,0.0002132085,0.9973831,0.0001583399,0.00007478042,0.001401688],"study_design_scores_gemma":[0.00001015735,0.0001729463,0.001099844,0.000006828393,0.00001089282,0.0001194666,0.00001668751,0.0005563839,0.9968165,0.0000263339,0.001159939,0.000004170854],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9867555,0.00105876,0.002863011,0.00007431206,0.00001894416,0.00009333256,0.0005628443,0.0001380873,0.008435128],"genre_scores_gemma":[0.996438,0.0006703463,0.001445866,0.00001847607,0.000006380903,0.00004565946,0.0003684063,0.0000207316,0.0009860569],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001556129,"threshold_uncertainty_score":0.00520575,"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."}}