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Record W2058076324 · doi:10.1021/om000668m

Reactions of the Si−H Functionalized Silicon-Bridged [1]Ferrocenophane Fe(<i>η</i>-C<sub>5</sub>H<sub>4</sub>)<sub>2</sub>SiMeH with Dicobalt Octacarbonyl:  Ring-Opening Metalization and the Synthesis of a Novel Sila[1]ferrocenophane with a Co(CO)<sub>4</sub> Substituent

2001· article· en· W2058076324 on OpenAlexaff
A. Berenbaum, Frieder Jäkle, Alan J. Lough, Ian Manners

Bibliographic record

VenueOrganometallics · 2001
Typearticle
Languageen
FieldChemistry
TopicOrganometallic Complex Synthesis and Catalysis
Canadian institutionsUniversity of Toronto
Fundersnot available
KeywordsChemistryIntramolecular forceSilyleneCrystallographyRing (chemistry)Yield (engineering)SiliconMetalationNuclear magnetic resonance spectroscopyStereochemistryOrganic chemistry

Abstract

fetched live from OpenAlex

Reaction of Co 2 (CO) 8 with the Si−H-functionalized sila[1]ferrocenophane Fe( η -C 5 H 4 ) 2 SiMeH ( 1a ) was found to result in metalation of silicon and ring-opening of the ferrocenophane, affording the orange crystalline silylene-bridged dicobalt heptacarbonyl complex ( η -C 5 H 5 )Fe( η -C 5 H 4 )Si[μ-Co 2 (CO) 7 ](Me) 6 in 45% yield. The novel red, crystalline sila[1]ferrocenophane Fe( η -C 5 H 4 ) 2 Si[Co(CO) 4 ](Me) ( 8 ), the first with a direct Si−M bond, was isolated in 23% yield when the reaction between 1a and Co 2 (CO) 8 was conducted in NEt 3 as a proton trap. The dinuclear complex 6 and metalated silicon-bridged ferrocenophane 8 were each characterized by multinuclear NMR spectroscopy, mass spectrometry, and single-crystal X-ray diffraction. [1]Ferrocenophanes Fe( η -C 5 H 4 ) 2 Si(Et)(H) ( 9 ) and Fe( η -C 5 H 4 ) 2 Si(Me)(D) ( 10 ) were prepared in order to investigate whether the ring-opening reaction that afforded 6 was an intramolecular or an intermolecular process. Mass spectral analysis of the products of the reaction of an equimolar mixture of 9 and 10 with Co 2 (CO) 8 showed only the presence of ( η -C 5 H 5 )Fe( η -C 5 H 4 )Si[μ-Co 2 (CO) 7 ](Et) ( 11 ) and ( η -C 5 H 4 D)Fe( η -C 5 H 4 )Si[μ-Co 2 (CO) 7 ](Me) ( 12 ); neither ( η -C 5 H 4 D)Fe( η -C 5 H 4 )Si[μ-Co 2 (CO) 7 ](Et) ( 11 ‘) nor ( η -C 5 H 5 )Fe( η -C 5 H 4 )Si[μ-Co 2 (CO) 7 ](Me) ( 12 ‘) were detected, which indicated that the ring-opening process was intramolecular. Compounds 11 and 12 were synthesized separately to provide comparative spectroscopic data for the mechanistic investigation.

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 imitation

Not 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.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: metacan-v3-hybrid-931329e0061cValidation status: machine_predicted_unvalidated
Candidate categoriesnone
Consensus categoriesnone
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: Bench or experimental
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.002
Threshold uncertainty score0.006

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0020.000

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.

Opus teacher head0.013
GPT teacher head0.210
Teacher spread0.197 · how far apart the two teachers sit on this one work
Validation statusscore_only:v0-immature-baseline · verbatim from the scoring run: score_only means the number may rank works, and no category label ships from it

Classification

machine, unvalidated

Machine predicted; a candidate call from one source (direct Gemma or distilled Codex), not a consensus.

The models applied no category: nothing in the taxonomy fit this work.
Study designBench or experimental
Domainnot available
GenreEmpirical

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".

Quick stats

Citations22
Published2001
Admission routes1
Has abstractyes

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