{"id":"W2330419672","doi":"10.15278/isms.2015.wg10","title":"FINGERPRINTS OF INTRAMOLECULAR HYDROGEN BONDS: SYNCHROTRON-BASED FAR IR STUDY OF THE CIS AND TRANS CONFORMERS OF 2-FLUOROPHENOL","year":2015,"lang":"en","type":"article","venue":"","topic":"Molecular Spectroscopy and Structure","field":"Chemistry","cited_by":0,"is_retracted":false,"has_abstract":true,"ca_institutions":"University of Manitoba","funders":"","keywords":"Conformational isomerism; Intramolecular force; Hydrogen bond; Infrared spectroscopy; Chemistry; Crystallography; Hydrogen atom; Stereochemistry; Molecule; Group (periodic table); Organic chemistry","routes":{"ca_aff":true,"ca_fund":false,"ca_venue":false,"about_ca":true,"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":[0.000125309,0.0002240042,0.0001508859,0.0003232287,0.0001927249,0.0001826593,0.0003305795,0.0002125829,0.001754957],"category_scores_gemma":[0.0001862755,0.0001165874,0.0001301848,0.0004183751,0.0002742431,0.0002885294,0.0001360627,0.0004228441,0.0001215258],"about_ca_system_candidate":false,"about_ca_system_consensus":false,"about_ca_system_score_codex":0.0001312982,"about_ca_system_score_gemma":0.00007141799,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0007159438,"about_ca_topic_score_gemma":0.0008365929,"domain_scores_codex":[0.9999208,0.00001105513,0.000001939277,0.00002055165,0.00002677602,0.0000188438],"domain_scores_gemma":[0.9998815,0.00003013915,0.00003743752,0.0000143394,0.00002048783,0.00001606925],"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":[0.000118241,0.00002220078,0.002342268,0.00003787476,0.00001144985,0.00005940103,0.000109669,0.0002253772,0.9942282,0.0001550554,0.00004570726,0.002644433],"study_design_scores_gemma":[0.00002194128,0.0004378213,0.1026819,0.00001447878,0.00003981366,0.0006880454,0.0005114482,0.004916866,0.8887923,0.0002685075,0.001590448,0.00003629863],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.9976718,0.0002044646,0.001566626,0.00002197724,0.000002834525,0.000001758607,0.0001004541,0.00002068285,0.0004093993],"genre_scores_gemma":[0.9985781,0.0001176303,0.0007593318,0.00001072861,0.000002070155,0.000003136792,0.0001675544,0.000008272499,0.0003533016],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.001754957,"threshold_uncertainty_score":0.005870938,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.008578962752433372,"score_gpt":0.2271126215708284,"score_spread":0.218533658818395,"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."}}