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Record W2326603476 · doi:10.1021/om500271p

Neutron Diffraction Characterization of C–H···Li Interactions in a Lithium Aluminate Polymer

2014· article· en· W2326603476 on OpenAlexaff
Jacqueline M. Cole, Paul G. Waddell, Andrew E. H. Wheatley, Garry J. McIntyre, Andrew J. Peel, Christopher W. Tate, David Linton

Bibliographic record

VenueOrganometallics · 2014
Typearticle
Languageen
FieldChemistry
TopicCoordination Chemistry and Organometallics
Canadian institutionsUniversity of New Brunswick
Fundersnot available
KeywordsChemistryAgostic interactionNeutron diffractionBimetallic stripAluminateLithium (medication)CrystallographyLanthanideNitrileAlkali metalDilithiumCrystal structureMetalOrganic chemistryIon

Abstract

fetched live from OpenAlex

The reaction of AlMe 3 with t BuLi in the presence of trimethylacetonitrile affords the bimetallic complex [ t Bu(Me)Al(μ-Me) 2 Li·NC( t Bu)] ∞ ( 1 ). Pseudotetrahedral Al centers form by the nucelophilic addition of t BuLi to AlMe 3 .The alkali-metal center is stabilized through coordination of the unreacted nitrile and polymer formation via the construction of Al(μ-Me) n Li ( n = 1, 2) motifs. Neutron diffraction evidences agostic interactions in the bridging methyl group to give further stabilization. There is only one previous report of a neutron structure of a lithium aluminate compound. This work therefore offers an important structural example of agostic interactions and the precise nature of Al(μ-Me) 2 Li bridging.

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 distilled prediction

Teacher imitation

Not calibrated prevalence, not ground truth. Human validation pending. Learned from the 10,348 direct Codex labels and 10,348 direct Gemma labels. Candidate is the union of thresholded teacher heads; consensus is their intersection. These outputs are machine_predicted_unvalidated and are not human labels or direct frontier model labels.

metaresearch head score (Codex)0.000
metaresearch head score (Gemma)0.000
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesInsufficient payload (model declined to judge)
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 score0.071
Threshold uncertainty score0.997

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.001
Science and technology studies0.0000.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0040.000

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 head0.010
GPT teacher head0.234
Teacher spread0.224 · 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 teacher head, not a consensus.

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

Citations14
Published2014
Admission routes1
Has abstractyes

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