{"id":"W4317951412","doi":"10.1016/j.molstruc.2023.135039","title":"Copper phthalocyanine tetrasulfonic acid (CuPcS) as an efficient recyclable catalyst for aromatic nitration using sodium nitrate","year":2023,"lang":"en","type":"article","venue":"Journal of Molecular Structure","topic":"Chemical Synthesis and Reactions","field":"Chemistry","cited_by":16,"is_retracted":false,"has_abstract":false,"ca_institutions":"","funders":"Malaviya National Institute of Technology, Jaipur; Ministry of Rural Affairs; Indian Institute of Technology Gandhinagar","keywords":"Nitration; Chemistry; Phthalocyanine; Catalysis; Organic chemistry; Nitro; Environmentally friendly; Combinatorial chemistry","routes":{"ca_aff":false,"ca_fund":true,"ca_venue":false,"about_ca":false,"invisible_to_affiliation_only":true},"retraction":null,"screen":null,"direct_labels":[],"prediction":{"model_version":"metacan-v3-hybrid-931329e0061c","candidate_categories":[],"consensus_categories":[],"category_scores_codex":[0.0002731666,0.0003554455,0.0002838623,0.0001911827,0.0001932701,0.0003346083,0.0005668501,0.000318601,0.0004175569],"category_scores_gemma":[0.0001657267,0.0001488606,0.0001793324,0.0001638375,0.0002500484,0.0002841008,0.0004704642,0.0002869512,0.0002707854],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0004171432,"about_ca_system_score_gemma":0.0003918776,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.001316091,"about_ca_topic_score_gemma":0.002753872,"domain_scores_codex":[0.9997963,0.00003754567,0.00001274922,0.00004084703,0.00006471892,0.00004781463],"domain_scores_gemma":[0.9999385,0.000008701075,0.00001487728,0.00001008961,0.00001514064,0.00001270019],"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":[0.0002052988,0.00004789006,0.0004861535,0.0002977501,0.00002148707,0.0002311105,0.0000791038,0.0007283714,0.9834822,0.000895343,0.0008479463,0.01267731],"study_design_scores_gemma":[0.00001135279,0.0001450448,0.0005110427,0.000005693473,0.0000204211,0.00009974509,0.00001117339,0.003124928,0.9934232,0.00003862876,0.002601127,0.000007699493],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9880122,0.001695908,0.005680958,0.0001234381,0.0000685948,0.00002645862,0.0000876839,0.0002208813,0.004083931],"genre_scores_gemma":[0.9953538,0.0005053088,0.001753699,0.00001848704,0.000009033877,0.000008507815,0.00008829553,0.00002831101,0.002234501],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001316091,"threshold_uncertainty_score":0.003026605,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01514131121072583,"score_gpt":0.2700007767111275,"score_spread":0.2548594655004017,"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."}}