{"id":"W2746108704","doi":"10.1021/acs.inorgchem.7b01895","title":"Structural and Electrochemical Consequences of [Cp*] Ligand Protonation","year":2017,"lang":"en","type":"article","venue":"Inorganic Chemistry","topic":"Organometallic Complex Synthesis and Catalysis","field":"Chemistry","cited_by":62,"is_retracted":false,"has_abstract":true,"ca_institutions":"","funders":"Division of Chemistry; Ryerson University; National Science Foundation","keywords":"Chemistry; Protonation; Ligand (biochemistry); Hydride; Crystallography; Rhodium; Metal; Diimine; Crystal structure; Stereochemistry; Redox; Catalysis; Medicinal chemistry; Inorganic chemistry; Organic chemistry","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":"codex-gemma-dda1882f352a","candidate_categories":["insufficient_payload"],"consensus_categories":[],"category_scores_codex":[0.00006307366,0.0001552725,0.0002516238,0.00001055499,0.0001899712,0.00008637486,0.000404146,0.0001255823,0.00527911],"category_scores_gemma":[0.0002765646,0.0001458543,0.00006449302,0.00003425465,0.0004174749,0.00009955391,0.0001482798,0.0001372663,0.000002965428],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.00003594875,"about_ca_system_score_gemma":0.00007118482,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.00002969855,"about_ca_topic_score_gemma":0.000002714422,"domain_scores_codex":[0.999088,0.000003067347,0.0002498215,0.0002919312,0.0001906377,0.0001765793],"domain_scores_gemma":[0.9989703,0.00004260907,0.0002876005,0.0005585555,0.00006408824,0.00007684875],"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":[0.00001231673,0.00001453841,0.004732496,0.0002047635,0.00005238008,0.00000186459,0.00005218378,2.061191e-8,0.9924966,0.00005068415,0.000007501665,0.002374701],"study_design_scores_gemma":[0.0002496763,0.000003920133,0.001744772,0.00003358391,0.00004645387,0.00005189879,0.00006752792,0.00001960526,0.9964651,0.0007272816,0.0004283304,0.0001618225],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9882846,0.000303532,0.000003263693,0.0002003305,0.00001172183,0.00004337712,0.00001597264,0.00002966768,0.0111075],"genre_scores_gemma":[0.9985681,0.00003247946,0.00006881786,0.000006143163,0.0001199091,0.00001180444,0.00001899818,0.00001479909,0.001158982],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.01028344,"threshold_uncertainty_score":0.9956302,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01272309663607575,"score_gpt":0.2368026263500068,"score_spread":0.224079529713931,"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."}}