{"id":"W1966756189","doi":"10.1107/s0108270101003675","title":"Two rhodamine derivatives: 9-[2-(ethoxycarbonyl)phenyl]-3,6-bis(ethylamino)-2,7-dimethylxanthylium chloride monohydrate and 3,6-diamino-9-[2-(methoxycarbonyl)phenyl]xanthylium chloride trihydrate","year":2001,"lang":"en","type":"article","venue":"Acta Crystallographica Section C Crystal Structure Communications","topic":"Crystal structures of chemical compounds","field":"Chemistry","cited_by":15,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Toronto","funders":"National Institute of Allergy and Infectious Diseases","keywords":"Xanthene; Chemistry; Chloride; Molecule; Hydrogen bond; Crystallography; Photochemistry; Medicinal chemistry; 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":[0.0001380739,0.000287401,0.0002609986,0.0001802893,0.0001060639,0.0002291929,0.0005687296,0.0004948612,0.0007382907],"category_scores_gemma":[0.0001743793,0.0001484354,0.000149612,0.000138187,0.0002290241,0.0002738329,0.0002543722,0.0004346347,0.0004083496],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003620336,"about_ca_system_score_gemma":0.0002212031,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.000952439,"about_ca_topic_score_gemma":0.0009591614,"domain_scores_codex":[0.9998068,0.000027159,0.00001517711,0.00006085221,0.00005510867,0.00003493119],"domain_scores_gemma":[0.999884,0.00001002881,0.00003985342,0.00001195463,0.00001317864,0.00004095047],"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":[0.0001096889,0.00004154657,0.0001595988,0.00006147157,0.000006309106,0.00004706402,0.00001338681,0.00006776915,0.9976453,0.0001127289,0.00005761781,0.001677487],"study_design_scores_gemma":[0.00005105565,0.0003951006,0.001191524,0.000003594179,0.00001539566,0.0002078436,0.00001242928,0.0006291866,0.9949477,0.000009663335,0.002528422,0.000008175769],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.988937,0.00210595,0.00506841,0.0001478898,0.00006061414,0.0001125726,0.0002663555,0.0002313784,0.003069713],"genre_scores_gemma":[0.986901,0.0008355793,0.00831447,0.00007555337,0.00001367081,0.00008409526,0.0004912147,0.00003186051,0.003252585],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.000952439,"threshold_uncertainty_score":0.002626777,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01718127635727942,"score_gpt":0.2669986773513133,"score_spread":0.2498174009940339,"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."}}