{"id":"W2142907097","doi":"10.1002/anie.200352858","title":"Toward an Improved Understanding of the Unusual Reactivity of Pd<sup>0</sup>/Trialkylphosphane Catalysts in Cross‐Couplings of Alkyl Electrophiles: Quantifying the Factors That Determine the Rate of Oxidative Addition","year":2003,"lang":"en","type":"article","venue":"Angewandte Chemie International Edition","topic":"Catalytic Cross-Coupling Reactions","field":"Chemistry","cited_by":177,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Division of Chemistry; Abbott Laboratories; National Institute of General Medical Sciences; Natural Sciences and Engineering Research Council of Canada; National Institutes of Health; National Science Foundation","keywords":"Electrophile; Reactivity (psychology); Catalysis; Alkyl; Oxidative addition; Chemistry; Ligand (biochemistry); Catalytic cycle; Coupling (piping); Oxidative phosphorylation; Combinatorial chemistry; Organic chemistry; Materials science; Biochemistry; Medicine","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0008855825,0.0004055626,0.0003475815,0.0001534847,0.0001594846,0.0007119953,0.0005090119,0.0006214402,0.001048068],"category_scores_gemma":[0.001043471,0.0002768512,0.0001828807,0.0001428434,0.000691218,0.002392714,0.0002953604,0.001047144,0.0002068849],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004462594,"about_ca_system_score_gemma":0.0002183449,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000379912,"about_ca_topic_score_gemma":0.0003939053,"domain_scores_codex":[0.9998442,0.00003642302,0.00001462205,0.00004429137,0.00003932862,0.00002102419],"domain_scores_gemma":[0.999731,0.0001526916,0.00005717155,0.0000227465,0.0000258912,0.00001043992],"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":[0.0001209534,0.00003862158,0.001339732,0.0002184502,0.00001657604,0.00010028,0.000129882,0.003129655,0.9753047,0.01075212,0.00008644691,0.008762526],"study_design_scores_gemma":[0.000006652768,0.00008995116,0.0007355331,0.000006243842,0.00001090079,0.0001420689,0.00005416671,0.005978369,0.9894573,0.002433109,0.001072964,0.00001279214],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9605818,0.002361292,0.03484048,0.0004269555,0.00001471243,0.00002033143,0.0001209444,0.00007869095,0.001554799],"genre_scores_gemma":[0.9820752,0.002763044,0.01418097,0.00006584912,0.000008928221,0.00003027409,0.0001183296,0.00001832957,0.0007390879],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001048068,"threshold_uncertainty_score":0.004683435,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.07273795711188115,"score_gpt":0.3104401786517656,"score_spread":0.2377022215398845,"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."}}