{"id":"W2902696625","doi":"10.1039/c8cc08713j","title":"Unconventional ionic ring-deconstruction pathways of a three-membered heterocycle","year":2018,"lang":"en","type":"article","venue":"Chemical Communications","topic":"Synthesis and characterization of novel inorganic/organometallic compounds","field":"Chemistry","cited_by":6,"is_retracted":false,"has_abstract":true,"ca_institutions":"Vancouver Biotech (Canada); University of British Columbia","funders":"Natural Sciences and Engineering Research Council of Canada; Deutsche Forschungsgemeinschaft; European Cooperation in Science and Technology","keywords":"Ring (chemistry); Ionic bonding; Chemistry; Deconstruction (building); Deprotonation; Base (topology); Quantum chemical; Stereochemistry; Organic chemistry; Molecule; Ion","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":[0.000103577,0.0001830954,0.0001107435,0.0001309324,0.0001752731,0.0003890846,0.0004232774,0.0002522495,0.001512364],"category_scores_gemma":[0.0001696044,0.0001159701,0.0001476679,0.000107361,0.000371642,0.0004963502,0.0002913275,0.0003820629,0.0002766866],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001997044,"about_ca_system_score_gemma":0.0001743642,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0001916887,"about_ca_topic_score_gemma":0.0004217371,"domain_scores_codex":[0.9999601,0.00000451792,0.000002764722,0.000009236459,0.000008722349,0.00001471609],"domain_scores_gemma":[0.9999225,0.00001565531,0.00001681926,0.00002475562,0.000007929745,0.00001224612],"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":[0.0003683761,0.00007165562,0.0009211128,0.0002205005,0.00002336289,0.001063831,0.0002627544,0.005665729,0.9381582,0.03883813,0.0003059781,0.01410027],"study_design_scores_gemma":[0.0000239271,0.0003032365,0.001183822,0.00001089373,0.00001386622,0.0005975088,0.00006819885,0.008620217,0.9796408,0.003413163,0.006095749,0.00002860694],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9862352,0.0002476497,0.006333587,0.00006023412,0.00001580773,0.00001627767,0.00009070247,0.0000785243,0.006922123],"genre_scores_gemma":[0.9965172,0.0001397321,0.001920145,0.00001975029,0.000002540183,0.000009855587,0.00005067035,0.00001407688,0.001326072],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001512364,"threshold_uncertainty_score":0.005059421,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.04963442819209109,"score_gpt":0.2572422891147519,"score_spread":0.2076078609226609,"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."}}