{"id":"W2007614362","doi":"10.1107/s010827010300920x","title":"<i>meso</i>-5,5,7,12,12,14-Hexamethyl-4,11-diaza-1,8-diazoniacyclotetradecane (<i>S</i>)-malate(2–) methanol disolvate: a chain of rings generated by two pairs of N—H...O hydrogen bonds","year":2003,"lang":"en","type":"article","venue":"Acta Crystallographica Section C Crystal Structure Communications","topic":"Crystal structures of chemical compounds","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"","keywords":"Methanol; Hydrogen bond; Chemistry; Molecule; Salt (chemistry); Crystallography; Ionic bonding; Chain (unit); Medicinal chemistry; Stereochemistry; Ion; Organic chemistry; Physics","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.00002976241,0.0001775456,0.0001137393,0.00007258099,0.00009292139,0.0001938053,0.0002199259,0.0001224371,0.003203626],"category_scores_gemma":[0.00005395441,0.00008243724,0.00005986611,0.000099789,0.0001437306,0.0001736926,0.0001134562,0.0001279516,0.000957934],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0002797692,"about_ca_system_score_gemma":0.0002293112,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0006591603,"about_ca_topic_score_gemma":0.001963066,"domain_scores_codex":[0.9999681,0.000003434996,0.000001603539,0.000008447224,0.000009187897,0.000009335932],"domain_scores_gemma":[0.9999839,0.000001205548,0.000005374673,0.000001373738,0.000001815767,0.000006306117],"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":[0.0003007035,0.00002716955,0.000258453,0.000147688,0.000009388785,0.0001481348,0.00002171159,0.0003091192,0.9899598,0.001516687,0.0007501389,0.006551014],"study_design_scores_gemma":[0.00008013527,0.0004776115,0.001265675,0.000008494697,0.000009634716,0.0003853502,0.00003737349,0.0007784556,0.9743201,0.0002020931,0.02242571,0.000009439267],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9659286,0.002019979,0.004533329,0.0002684033,0.0001806179,0.0000723398,0.0007622665,0.0002964521,0.02593794],"genre_scores_gemma":[0.9867992,0.001223246,0.002397306,0.0001150834,0.00001925057,0.00002739038,0.0005448741,0.00002406099,0.008849625],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003203626,"threshold_uncertainty_score":0.01071721,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01117853313163796,"score_gpt":0.2368032662811342,"score_spread":0.2256247331494962,"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."}}