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Record W2334276619 · doi:10.1021/ic026269w

Structural Diversity of Lithium Sulfenamides: <sup>7</sup>Li NMR Studies in Solution and Crystal Structures of [Li<sub>2</sub>(η<sup>2</sup>-(CH<sub>3</sub>)<sub>3</sub>C−NS−C<sub>6</sub>H<sub>4</sub>CH<sub>3</sub>-4)<sub>2</sub>(THF)<sub>2</sub>] and [Li<sub>2</sub>(η<sup>1</sup>-4-CH<sub>3</sub>C<sub>6</sub>H<sub>4</sub>−NS−C<sub>6</sub>H<sub>4</sub>CH<sub>3</sub>-4)<sub>2</sub>(THF)<sub>4</sub>]

2003· article· en· W2334276619 on OpenAlexaff
A.H. Mahmoudkhani, Sarah Rauscher, Brian Grajales, Ignacio Vargas‐Baca

Bibliographic record

VenueInorganic Chemistry · 2003
Typearticle
Languageen
FieldChemistry
TopicCoordination Chemistry and Organometallics
Canadian institutionsMcMaster University
Fundersnot available
KeywordsChemistrySulfenamideCrystal structureCrystallographyLithium (medication)Nuclear magnetic resonance spectroscopyNMR spectra databaseTolueneElectron paramagnetic resonanceStereochemistryMedicinal chemistrySpectral lineOrganic chemistryNuclear magnetic resonance

Abstract

fetched live from OpenAlex

Two lithium sulfenamides were prepared by reaction of (CH(3))(3)C-N(H)-S-C(6)H(4)CH(3)-4 (1) and 4-CH(3)C(6)H(4)-N(H)-S-C(6)H(4)CH(3)-4 (2) with an alkyllithium. The unsolvated sulfenamide Li[(CH(3))(3)C-NS-C(6)H(4)CH(3)-4] (3) was soluble enough for variable-temperature (VT) (7)Li NMR to provide evidence of a dynamic exchange of oligomers in solution. The crystal structures of the solvated sulfenamides of [Li(2)(eta(2)-(CH(3))(3)C-NS-C(6)H(4)CH(3)-4)(2)(THF)(2)] (4) and of [Li(2)(eta(1)-4-CH(3)C(6)H(4)-NS-C(6)H(4)CH(3)-4)(2)(THF)(4)] (6) consisted of dimers in which the anions display different hapticities. The VT (7)Li NMR spectra of 4 suggest that the two different structures exist in equilibrium in toluene-THF mixtures. These compounds are easily oxidized to the neutral thioaminyl radicals as identified by EPR spectroscopy.

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)0.018
metaresearch head score (Gemma)0.017
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMetaresearch, Meta-epidemiology (narrow), Meta-epidemiology (broad), Bibliometrics, Science and technology studies, Scholarly communication, Open science, Research integrity, Insufficient payload (model declined to judge)
Consensus categoriesMeta-epidemiology (narrow), Meta-epidemiology (broad), Bibliometrics, Science and technology studies, Scholarly communication, Open science, Research integrity
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 score0.036
Threshold uncertainty score0.998

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0180.017
Meta-epidemiology (narrow)0.0370.044
Meta-epidemiology (broad)0.0330.018
Bibliometrics0.0130.029
Science and technology studies0.0180.023
Scholarly communication0.0090.018
Open science0.0230.023
Research integrity0.0280.036
Insufficient payload (model declined to judge)0.0010.004

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 head0.016
GPT teacher head0.229
Teacher spread0.212 · 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; both teacher heads agree on what is shown here.

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

Citations7
Published2003
Admission routes1
Has abstractyes

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