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Record W2082653475 · doi:10.1021/je050132d

Formation Constants and Coordination Thermodynamics for Binary and Ternary Complexes of Copper(II), <scp>l</scp>-Hydroxyproline, and an Amino Acid Enantiomer

2005· article· en· W2082653475 on OpenAlexaff
Nooshafarin Sanaie, Charles A. Haynes

Bibliographic record

VenueJournal of Chemical & Engineering Data · 2005
Typearticle
Languageen
FieldChemistry
TopicChemical Thermodynamics and Molecular Structure
Canadian institutionsCanada's Michael Smith Genome Sciences CentreUniversity of British Columbia
Fundersnot available
KeywordsTernary operationCopperEnantiomerChemistryThermodynamicsBinary numberStereochemistryOrganic chemistryMathematicsPhysicsComputer science

Abstract

fetched live from OpenAlex

While a rich database is available at or near room temperature (288.15 to 298.15 K) defining the chemical equilibria of solutions containing the copper(II) ion and an amino acid, data describing the temperature dependence of reaction thermodynamics for these systems remain scarce. In addition, data defining enthalpy, entropy, and heat capacity changes for the formation of mixed amino acid chelate complexes are extremely limited, hindering our understanding of the driving forces for complex formation and stabilization. Here, protonation constants and concentration-based equilibrium constants for Cu(II)−amino acid complexes are reported from 288.15 to 348.15 K for leucine, valine, proline, phenylalanine, and hydroxyproline in aqueous solutions containing 0.1 M KNO 3 . The logarithmic (ln) values of the protonation and binary stepwise concentration equilibrium constants ( K i ) for each amino acid ligand are found to be linearly dependent on the inverse of temperature, indicating negligible change in heat capacity for each of these protonation and complexation reactions. However, ln( K i ) data for ternary complexes formed between Cu(II), l -hydroxyproline, and any one of the other amino acid enantiomers show a nonlinear dependence on inverse temperature, indicating a negative change in heat capacity. Enthalpy and entropy changes for ternary complex formation are therefore temperature-dependent quantities. Our thermodynamic data, when combined with statistical analysis of reaction stoichiometry, reveal that ternary Cu(II)( d ‘ or l ‘)( l -hydroxyproline) complexes are consistently hyperstable as compared to their parent bis-binary complexes at all solution temperatures studied.

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 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 score0.482
Threshold uncertainty score0.582

Codex and Gemma teacher scores by category

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

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 head0.012
GPT teacher head0.248
Teacher spread0.237 · 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.

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

Citations23
Published2005
Admission routes1
Has abstractyes

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