Cyclopentadienyl Yttrium Complexes Bearing a Fluorinated Aryloxide Functionality
Bibliographic record
Abstract
The ligand C 5 H 5 (CH 2 CAr F 2 OH) ( 3 ) (Ar F = 3,5-C 6 H 3 (CF 3 ) 2 ) was prepared in moderate yield (65%) by ring opening of the epoxide Ar F 2 C(O)CH 2 ( 2 ) with NaCp. Epoxide 2 was accessible in two steps from commercially available precursors. Reaction of the dilithium salt of 3 with YCl 3 afforded the ate complex { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]} 2 Y - Li + {THF} 2 ( 4a ). Exposure of 4a to vacuum resulted in partial desolvation to { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]} 2 Y - Li + {THF} ( 4b ). The chloride complex { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}YCl{THF} 2 ( 5 ) could only be prepared by protonolysis of {Y[N(SiMe 3 ) 2 ] 2 (THF) 2 ( μ -Cl)} 2 with 1 equiv of 3 . Metathesis reactions of 5 with 1 equiv of NaN(SiMe 3 ) 2, NaCp, and LiCH(SiMe 3 ) 2 afforded { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}Y{N(SiMe 3 ) 2 }{THF} n ( 6a, n = 2; 6b, n = 1), { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}Y{ η 5 -C 5 H 5 }{THF} n ( 8a, n = 2; 8b, n = 1), and { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}Y{CH(SiMe 3 ) 2 }{THF} 2 ( 9 ), respectively. Metathesis of 5 with 2 equiv of Na[N(SiMe 3 ) 2 ] or LiCH(SiMe 3 ) 2 afforded the anionic “ ate ” complexes { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}{N(SiMe 3 ) 2 } 2 Y - Na + {THF} 2 ( 7 ) and { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}{CH(SiMe 3 ) 2 } 2 Y - Li + {THF} 2 ( 10 ), respectively. The phenoxide { η 5: η 1 -C 5 H 4 [CH 2 C(O)(3,5-C 6 H 3 (CF 3 ) 2 ) 2 ]}Y{O-2,6- t -Bu 2 C 6 H 3 }{THF} 2 ( 11 ) could not be prepared by salt metathesis but was isolated by protonolysis of Y[O-2,6- t -Bu 2 C 6 H 3 ][CH(SiMe 3 ) 2 ] 2 [THF] 2 with 1 equiv of 3 . The crystal structures of ate complex 4a and phenoxide 11 were established by X-ray crystallography.
Fetched live from OpenAlex and de-inverted. Abstracts are not stored in this database: the inverted indexes are 8.6 GB of the frame’s 9.3 GB of text, and the host has 13 GB free.
How this classification was reachedexpand
Full frame machine prediction
Teacher imitationNot calibrated prevalence, not ground truth. Human validation pending. The Gemma side is a direct model label for every work in the frame, read from the title-only record. The Codex side is a classifier learned from the 10,348 direct Codex labels and calibrated to design-weighted sample rates; fields without enough sample support carry no Codex call. Candidate is the union of the two sides; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels.
Distilled classifier scores by category (both heads)
| Category | Codex | Gemma |
|---|---|---|
| Metaresearch | 0.000 | 0.000 |
| Meta-epidemiology (narrow) | 0.000 | 0.000 |
| Meta-epidemiology (broad) | 0.000 | 0.000 |
| Bibliometrics | 0.000 | 0.000 |
| Science and technology studies | 0.000 | 0.000 |
| Scholarly communication | 0.000 | 0.000 |
| Open science | 0.000 | 0.000 |
| Research integrity | 0.000 | 0.000 |
| Insufficient payload (model declined to judge) | 0.004 | 0.001 |
Machine scores (provisional)
The two teacher heads of the student model, read on this work. A score orders the frame for review; it never asserts a category, and the validation status ships verbatim with every row.
Baseline scores from an immature model (maturity gate not passed, 7 training rounds). Scores rank; they never assert a category.
score_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from itClassification
machine, unvalidatedMachine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.
How this classification was reached, model by model and score by score, is at the end of the page under "How this classification was reached".