{"id":"W2896033828","doi":"10.1007/s10870-018-0737-z","title":"The Structure of Cis-2,2′-Azopyridine in the Solid State","year":2018,"lang":"en","type":"article","venue":"Journal of Chemical Crystallography","topic":"Photochromic and Fluorescence Chemistry","field":"Materials Science","cited_by":3,"is_retracted":false,"has_abstract":false,"ca_institutions":"Western University","funders":"Natural Sciences and Engineering Research Council of Canada; National Natural Science Foundation of China","keywords":"Chemistry; Conformational isomerism; Monoclinic crystal system; Crystallography; Crystal structure; Molecule; Lone pair; Hydrogen bond; Solid-state; Dihedral angle; Organometallic chemistry; Stereochemistry; Physical chemistry; 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":[],"consensus_categories":[],"category_scores_codex":[0.0006005323,0.0001226435,0.000248262,0.00005669466,0.00006417048,0.000050617,0.0009244871,0.00007333937,0.00009640933],"category_scores_gemma":[0.0001455793,0.00006005073,0.0001708733,0.0003224136,0.0008704246,0.0001115237,0.00006086977,0.000307452,8.174387e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0000184659,"about_ca_system_score_gemma":0.00007087732,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000004366158,"about_ca_topic_score_gemma":0.00000328741,"domain_scores_codex":[0.9985286,0.00005429098,0.0005880494,0.0001151757,0.0004481925,0.0002656818],"domain_scores_gemma":[0.9988077,0.0001974807,0.0004448654,0.0002591209,0.0002226977,0.00006810581],"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":[0.0002103859,0.00004218002,0.0004539275,0.00001536241,0.00001241062,0.000008742356,0.0004137808,0.000001664251,0.9971165,0.0000247956,0.001617509,0.00008273884],"study_design_scores_gemma":[0.0003546937,0.0001079017,0.0005589137,0.00004773259,0.00001345161,0.00009847397,0.0002001579,0.00001082413,0.9903333,0.007528569,0.0006733194,0.00007265303],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9989831,0.0002175316,0.00005336751,0.0002721952,0.0001477319,0.00007499723,0.00001815226,0.000004259203,0.0002286301],"genre_scores_gemma":[0.9992515,0.00003921188,0.0003159079,0.0001282088,0.0002527258,8.405044e-7,8.224402e-7,0.000007129647,0.00000367332],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.007503773,"threshold_uncertainty_score":0.3207116,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.006284564861720059,"score_gpt":0.2443523633516169,"score_spread":0.2380677984898968,"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."}}