{"id":"W4411642707","doi":"10.1021/acs.cgd.5c00295","title":"Synthesis and X-ray Structures of Bis-Functional Resorcinarene Crown Ethers","year":2025,"lang":"en","type":"article","venue":"Crystal Growth & Design","topic":"Molecular Sensors and Ion Detection","field":"Chemistry","cited_by":2,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Windsor","funders":"Natural Sciences and Engineering Research Council of Canada; Alliance de recherche numérique du Canada; Jyväskylän Yliopisto; Academy of Finland; National Science Foundation","keywords":"Chemistry; Crown ether; Molecule; Tetrafluoroborate; Intramolecular force; Hydrogen bond; Acetonitrile; Dimer; Solvent; Resorcinarene; Host–guest chemistry; Ether; Crystallography; Calixarene; Resorcinol; Medicinal chemistry; Stereochemistry; Supramolecular chemistry; Organic chemistry; Catalysis; Ionic liquid","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":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0001228801,0.0003292155,0.0002044276,0.0002283767,0.0001314925,0.0002255264,0.000402173,0.0002463693,0.003265165],"category_scores_gemma":[0.0001747892,0.0001740048,0.0001711454,0.0002354562,0.0001236396,0.0002454132,0.0001271703,0.0005047859,0.001081376],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004351325,"about_ca_system_score_gemma":0.0001541613,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007141951,"about_ca_topic_score_gemma":0.001059568,"domain_scores_codex":[0.9999379,0.00000615218,0.000003685214,0.00001079335,0.00002730816,0.00001417023],"domain_scores_gemma":[0.9999212,0.00001076587,0.00002143674,0.00001172113,0.00002089071,0.00001401173],"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":[0.00007162911,0.00001531604,0.00005115501,0.00005239483,0.000004924229,0.00006796289,0.0000280854,0.0005735717,0.9951417,0.0006346838,0.000232611,0.003125802],"study_design_scores_gemma":[0.00001516985,0.00009357006,0.0006291688,0.000004245877,0.000008062893,0.00006732409,0.00001472321,0.001777033,0.9893796,0.00008133447,0.0079206,0.000009263701],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9661217,0.002886685,0.01821849,0.0002049266,0.0000665057,0.0001184761,0.003305071,0.0004669113,0.008611198],"genre_scores_gemma":[0.9419752,0.003950238,0.0371788,0.00005563799,0.00001848777,0.0001024796,0.005066743,0.0001585389,0.01149373],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003265165,"threshold_uncertainty_score":0.01092309,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01437567742374611,"score_gpt":0.2177063332947804,"score_spread":0.2033306558710343,"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."}}