{"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":"codex-gemma-dda1882f352a","candidate_categories":["metaepi_narrow","sts","research_integrity","insufficient_payload"],"consensus_categories":["metaepi_narrow","sts","research_integrity"],"category_scores_codex":[0.0008319307,0.002039393,0.001860653,0.001138418,0.002143437,0.0008931814,0.003622715,0.001308317,0.001141055],"category_scores_gemma":[0.0008479012,0.002117352,0.0008346965,0.003370909,0.002806362,0.001425156,0.002028785,0.003689515,0.000001094951],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0006123871,"about_ca_system_score_gemma":0.0003101454,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001344164,"about_ca_topic_score_gemma":0.001792759,"domain_scores_codex":[0.9910674,0.0006103134,0.002393941,0.002437955,0.001413239,0.002077128],"domain_scores_gemma":[0.9888287,0.002211506,0.001469896,0.005487143,0.0008068247,0.001195967],"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":[0.0009373227,0.0002897762,0.003632089,0.0001995666,0.000630953,0.00004167559,0.0007195298,0.0001252161,0.9910697,0.0006090929,0.0001894301,0.001555703],"study_design_scores_gemma":[0.01288783,0.0007038979,0.01374532,0.0006311503,0.001621879,0.002647153,0.004857167,0.007729028,0.2065112,0.04102428,0.6991797,0.008461406],"study_design_candidate":"bench_or_experimental","study_design_consensus":null,"genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9728796,0.002440698,0.002381519,0.00267977,0.0008416199,0.0009528232,0.0005794588,0.00139032,0.01585415],"genre_scores_gemma":[0.9868194,0.003036572,0.006224757,0.0004367443,0.001104353,0.0003079718,0.001101859,0.0003846235,0.0005836691],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.7845585,"threshold_uncertainty_score":0.9999882,"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."}}