{"id":"W2326928742","doi":"10.1107/s205698901500732x","title":"Crystal structure of tetraethylammonium chloride 3,4,5,6-tetrafluoro-1,2-diiodobenzene","year":2015,"lang":"en","type":"article","venue":"Acta Crystallographica Section E Crystallographic Communications","topic":"Crystallography and molecular interactions","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Ottawa","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Halogen; Tetraethylammonium chloride; Halogen bond; Crystallography; Halide; Chloride; Acceptor; Crystal structure; Ion; Tetraethylammonium; Molecule; van der Waals force; Square pyramidal molecular geometry; Hydrogen bond; Inorganic chemistry; Potassium; 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":["metaepi_narrow"],"consensus_categories":[],"category_scores_codex":[0.0005280645,0.0008908487,0.0009588991,0.002098639,0.000773269,0.0001904131,0.002686268,0.0008431383,0.000703407],"category_scores_gemma":[0.000454077,0.0009652267,0.001201908,0.004064472,0.001744422,0.0008242267,0.0008010931,0.001814431,8.320083e-7],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001679809,"about_ca_system_score_gemma":0.0003700343,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0009542127,"about_ca_topic_score_gemma":0.003337377,"domain_scores_codex":[0.9947447,0.000309785,0.001729476,0.001064588,0.001139757,0.001011646],"domain_scores_gemma":[0.9916929,0.0005321654,0.001024299,0.004632292,0.001300747,0.000817603],"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":[0.0003113471,0.0009736665,0.006303064,0.0001504751,0.0007677749,0.00001064419,0.0007675829,0.0001637251,0.9862602,0.003093417,0.0008819291,0.0003161386],"study_design_scores_gemma":[0.006593341,0.0009339591,0.006228125,0.0005484344,0.001356414,0.001055108,0.01426231,0.0009381035,0.03268768,0.02084529,0.9110565,0.003494791],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9628564,0.001846537,0.001883223,0.001150958,0.0009251055,0.0005815533,0.0008077142,0.001088668,0.02885986],"genre_scores_gemma":[0.9943499,0.001136663,0.002637733,0.0001285283,0.0002569002,0.000130798,0.001026065,0.0001661084,0.0001673048],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.9535726,"threshold_uncertainty_score":0.9992798,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.0233232095129061,"score_gpt":0.2616224180019867,"score_spread":0.2382992084890806,"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."}}