{"id":"W2319731555","doi":"10.1021/om3001197","title":"α- and β-Agostic Alkyl–Titanocene Complexes","year":2012,"lang":"en","type":"article","venue":"Organometallics","topic":"Organometallic Complex Synthesis and Catalysis","field":"Chemistry","cited_by":32,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Manitoba; Queen's University","funders":"","keywords":"Agostic interaction; Chemistry; Hydride; Alkyl; Chirality (physics); Ether; Medicinal chemistry; Hydrogen; Stereochemistry; Crystallography; 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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.0002045245,0.0002928723,0.0004140573,0.000106271,0.0001799714,0.00008649522,0.000268376,0.0001082223,0.068928],"category_scores_gemma":[0.0001423987,0.0002724969,0.0001239809,0.000333382,0.0001441141,0.0002795823,0.0002259633,0.0001498424,0.0004083352],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00005953544,"about_ca_system_score_gemma":0.00002243356,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00001609995,"about_ca_topic_score_gemma":0.000005849837,"domain_scores_codex":[0.9984707,0.00001869769,0.0003299734,0.0003285926,0.0002791697,0.0005728325],"domain_scores_gemma":[0.9987993,0.0001607707,0.0001139473,0.0005380882,0.00004209119,0.000345801],"domain_codex":null,"domain_gemma":null,"domain_candidate":null,"domain_consensus":null,"study_design_codex":"bench_or_experimental","study_design_gemma":"not_applicable","study_design_scores_codex":[0.00002607987,0.0008109438,0.04133161,0.0003660475,0.0006760706,0.00001182084,0.001151383,0.000001681852,0.8252071,0.02164938,0.0004528099,0.108315],"study_design_scores_gemma":[0.001089863,0.00003994746,0.08375403,0.00005931007,0.0009506217,0.0003204949,0.001474976,0.0001216664,0.2115486,0.001452226,0.6973367,0.001851606],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9439926,0.004291516,0.0001516554,0.0001986907,0.00009859535,0.00005033,0.00005039049,0.0001595581,0.05100668],"genre_scores_gemma":[0.9910929,0.0002629483,0.0009252505,0.0001010847,0.0003529718,0.00001157831,0.00006639111,0.00006463582,0.007122297],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.6968839,"threshold_uncertainty_score":0.9999727,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01595153990785876,"score_gpt":0.2198843529600223,"score_spread":0.2039328130521636,"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."}}