{"id":"W2054597052","doi":"10.1007/s10870-008-9340-z","title":"An X-ray Crystallographic Study of the Related Triazenes, 1,4-Di[(E)-2-(2-nitrophenyl)-1-diazenyl]piperazine and Methyl 4-{(E)-2-(4-methylpiperazino)-1-diazenyl}benzoate","year":2008,"lang":"en","type":"article","venue":"Journal of Chemical Crystallography","topic":"Chemical Reactions and Mechanisms","field":"Chemistry","cited_by":13,"is_retracted":false,"has_abstract":false,"ca_institutions":"Saint Mary's University; Queen's University","funders":"","keywords":"Piperazine; Triclinic crystal system; Triazene; Monoclinic crystal system; Chemistry; Cyclohexane conformation; Ring (chemistry); Crystal structure; Dihedral angle; Crystallography; Stereochemistry; Hydrogen bond; Molecule; 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":[0.0001444976,0.0001487922,0.0002339653,0.0001168727,0.0002807086,0.0002370679,0.0003947259,0.0002533776,0.001898406],"category_scores_gemma":[0.0001830939,0.0001260081,0.0001441963,0.0002340399,0.0002539081,0.0001877702,0.00008439121,0.0006897223,0.0002149589],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0003771262,"about_ca_system_score_gemma":0.0003136559,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.003004024,"about_ca_topic_score_gemma":0.002580336,"domain_scores_codex":[0.999938,0.00001162696,0.000003015524,0.000008106022,0.00002509978,0.00001408372],"domain_scores_gemma":[0.999936,0.00001477856,0.00001455638,0.000005068141,0.00001705512,0.00001257233],"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":[0.0009035885,0.0002270746,0.002351169,0.0004863251,0.00003694349,0.0005280456,0.0002221008,0.00210309,0.9769555,0.002708277,0.002430207,0.01104771],"study_design_scores_gemma":[0.000480345,0.001276011,0.0435718,0.00006138096,0.0001323066,0.002617783,0.0006907176,0.01146046,0.8864133,0.0007056266,0.05254272,0.00004748104],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9811364,0.006648872,0.00148479,0.0009709544,0.00005570409,0.00004198102,0.0006856411,0.00004149502,0.008934322],"genre_scores_gemma":[0.9866377,0.004606607,0.002434314,0.0001920814,0.00002727975,0.00001799386,0.001638799,0.00001891024,0.004426319],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.003004024,"threshold_uncertainty_score":0.006350815,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01147373394552063,"score_gpt":0.2312360974739651,"score_spread":0.2197623635284445,"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."}}