{"id":"W1994132475","doi":"10.1021/cg700798z","title":"Engineering Hydrogen-Bonded Molecular Crystals Built from 1,3,5-Substituted Derivatives of Benzene: 6,6′,6′′-(1,3,5-Phenylene)tris-1,3,5-triazine-2,4-diamines","year":2008,"lang":"en","type":"article","venue":"Crystal Growth & Design","topic":"Crystallography and molecular interactions","field":"Chemistry","cited_by":26,"is_retracted":false,"has_abstract":true,"ca_institutions":"Université de Montréal","funders":"","keywords":"Hydrogen bond; Molecule; Chemistry; Alkyl; Intermolecular force; Crystal engineering; Phenylene; Aryl; Triazine; Crystallography; Group (periodic table); Stereochemistry; Polymer chemistry; Polymer; 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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001067312,0.0002407354,0.0002887782,0.0001425028,0.0001930316,0.0004083167,0.0004442692,0.000239959,0.001184149],"category_scores_gemma":[0.0002192683,0.0002756988,0.0001866184,0.0002354539,0.0001779678,0.0002605049,0.0002639669,0.0005364643,0.0003404032],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004408634,"about_ca_system_score_gemma":0.000400191,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001311779,"about_ca_topic_score_gemma":0.00345543,"domain_scores_codex":[0.9999129,0.00001399568,0.000006076677,0.00001740248,0.0000227535,0.00002692288],"domain_scores_gemma":[0.9998504,0.00002272049,0.00005413359,0.00001566006,0.0000221169,0.00003493708],"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":[0.0002446784,0.0001708691,0.0006780405,0.0001932231,0.00003086859,0.0002031772,0.00007904898,0.003839801,0.9853148,0.003574243,0.0006390349,0.005032147],"study_design_scores_gemma":[0.0001150743,0.0004775928,0.00156179,0.00002090464,0.00004036476,0.00008980664,0.00004896327,0.02330356,0.9683115,0.0002266411,0.005784145,0.00001954576],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9908512,0.0003333405,0.00498088,0.00006628069,0.00009381475,0.00004429615,0.0002902701,0.0001263336,0.003213545],"genre_scores_gemma":[0.987102,0.000502796,0.009361638,0.00003353177,0.00001173735,0.00009445329,0.000338408,0.0000772053,0.002478143],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001311779,"threshold_uncertainty_score":0.003961325,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.02224964303260245,"score_gpt":0.226433770448889,"score_spread":0.2041841274162865,"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."}}