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Record W2084853411 · doi:10.1021/om900778u

Steric and Solvent Effects on the Secondary Kinetic α-Deuterium Isotope Effects in the Reaction of Methyl Iodide with Organoplatinum(II) Complexes: Application of a Second-Order Technique in Measuring the Rates of Rapid Processes

2009· article· en· W2084853411 on OpenAlexaff
Sepideh Habibzadeh, Mehdi Rashidi, S. Masoud Nabavizadeh, Leila Mahmoodi, Fatemeh Niroomand Hosseini, Richard J. Puddephatt

Bibliographic record

VenueOrganometallics · 2009
Typearticle
Languageen
FieldChemistry
TopicRadioactive element chemistry and processing
Canadian institutionsWestern University
Fundersnot available
KeywordsChemistrySteric effectsKinetic isotope effectLigand (biochemistry)IodideSolventMethyl iodideReaction rate constantDenticityMedicinal chemistryPlatinumDeuteriumSolvent effectsBipyridineInorganic chemistryPhotochemistryStereochemistryOrganic chemistryKineticsCatalysisCrystal structure

Abstract

fetched live from OpenAlex

The kinetic isotope effects (KIEs), k H / k D, have been determined for reaction of CH 3 I/CD 3 I with several organoplatinum(II) complexes [PtR 2 (NN)], in which the bidentate NN ligand is bpy = 2,2′-bipyridine, t Bu 2 bpy = 4,4′-bis( tert -butyl)-2,2′-bipyridine, phen = 1,10-phenanthroline, or Me 2 phen = 2,9-dimethyl-1,10-phenanthroline, at different temperatures and in solvents having different polarities. The values obtained for the secondary α-deuterium KIEs are close to 1 and are dependent on the solvent; values of up to 7−10% larger are obtained for the reactions in the polar solvent acetone as compared to those obtained in the nonpolar solvent benzene. The data also indicate that the steric crowding around the square-planar coordination sphere of the platinum(II) complexes with the ligand Me 2 phen results in higher KIEs. The reactions involving dimethylplatinum(II) complexes, [PtMe 2 (NN)], were fast, and a 1:1 molar ratio (of complex and reagent) technique was successfully used to measure the rate constants accurately by conventional UV−visible spectroscopy. It is shown that there are significant advantages to measuring the reaction rates under second-order condition, as compared to the usual pseudo-first-order method.

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)0.001
metaresearch head score (Gemma)0.001
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 score0.001
Threshold uncertainty score0.004

Distilled classifier scores by category (both heads)

CategoryCodexGemma
Metaresearch0.0010.001
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.001
Scholarly communication0.0010.001
Open science0.0000.000
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0010.000

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 head0.011
GPT teacher head0.235
Teacher spread0.223 · 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

Citations41
Published2009
Admission routes1
Has abstractyes

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