{"id":"W4387692535","doi":"10.1002/chem.202303059","title":"Chromium(VI) Oxyfluoride Dianions, [Cr<sub>2</sub>O<sub>4</sub>F<sub>6</sub>]<sup>2−</sup> and [CrO<sub>2</sub>F<sub>4</sub>]<sup>2−</sup>; Syntheses and Structures of [XeF<sub>5</sub>]<sub>2</sub>[Cr<sub>2</sub>O<sub>4</sub>F<sub>6</sub>], [XeF<sub>5</sub>]<sub>2</sub>[Cr<sub>2</sub>O<sub>4</sub>F<sub>6</sub>] ⋅ <i>n</i>X (X=HF, <i>n</i>=4; X=XeOF<sub>4</sub>, <i>n</i>=2), and [XeF<sub>5</sub>][Xe<sub>2</sub>F<sub>11</sub>][CrO<sub>2</sub>F<sub>4</sub>]","year":2023,"lang":"en","type":"article","venue":"Chemistry - A European Journal","topic":"Inorganic Fluorides and Related Compounds","field":"Chemistry","cited_by":1,"is_retracted":false,"has_abstract":true,"ca_institutions":"McMaster University","funders":"Natural Sciences and Engineering Research Council of Canada","keywords":"Chemistry; Crystallography; Raman spectroscopy; Octahedron; Crystal structure; Chromium; Dimer; X-ray crystallography; Ion; Natural bond orbital; Inorganic chemistry; Physical chemistry; Density functional theory; Computational chemistry; Diffraction","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":"codex-gemma-dda1882f352a","candidate_categories":["metaresearch","metaepi_narrow","metaepi_broad","bibliometrics","sts","scholarly_communication","open_science","research_integrity","insufficient_payload"],"consensus_categories":["metaresearch","metaepi_narrow","metaepi_broad","bibliometrics","sts","scholarly_communication","open_science","research_integrity"],"category_scores_codex":[0.035782,0.05861698,0.0477186,0.02478569,0.03113118,0.02556127,0.03968152,0.03527178,0.0006341102],"category_scores_gemma":[0.0198553,0.06692456,0.03064242,0.04300595,0.03126448,0.02618792,0.03068231,0.06645261,0.01467754],"about_ca_system_candidate":true,"about_ca_system_consensus":true,"about_ca_system_score_codex":0.02663859,"about_ca_system_score_gemma":0.02464587,"about_ca_topic_candidate":false,"about_ca_topic_consensus":false,"about_ca_topic_score_codex":0.0005575944,"about_ca_topic_score_gemma":0.003491587,"domain_scores_codex":[0.7986076,0.0201105,0.04883534,0.04680908,0.034976,0.05066147],"domain_scores_gemma":[0.8486757,0.01875975,0.03975879,0.03649683,0.01976021,0.03654866],"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":[0.0159747,0.01334921,0.002935197,0.01527255,0.02084567,0.02395157,0.007574992,0.00844985,0.7027159,0.0005361295,0.08271203,0.1056822],"study_design_scores_gemma":[0.04858207,0.006782822,0.004416547,0.02130811,0.0225934,0.03174834,0.009137216,0.009026797,0.7800124,0.003906919,0.009532053,0.05295332],"study_design_candidate":"bench_or_experimental","study_design_consensus":"bench_or_experimental","genre_codex":"empirical","genre_gemma":"empirical","genre_scores_codex":[0.8657348,0.0320508,0.002371263,0.004812797,0.02118378,0.02632625,0.02608997,0.0180578,0.003372506],"genre_scores_gemma":[0.7849909,0.1282013,0.0009767762,0.007503086,0.02828897,0.008278102,0.01976835,0.02180768,0.0001848869],"genre_candidate":"empirical","genre_consensus":"empirical","teacher_disagreement_score":0.09615047,"threshold_uncertainty_score":0.9928653,"prediction_status":"machine_predicted_unvalidated"},"machine_scores":{"provisional":true,"baseline":true,"maturity_gate_passed":false,"score_opus":0.01013353824008919,"score_gpt":0.2035176185232426,"score_spread":0.1933840802831534,"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."}}