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Record W2010128918 · doi:10.1002/jrs.2151

Vibrational spectroscopic study of the hydrated platinum(II), palladium(II) and <i>cis</i>‐diammineplatinum(II) ions in acidic aqueous solutions

2008· article· en· W2010128918 on OpenAlexafffund
László Kocsis, J. Mink, Farideh Jalilehvand, Luke J. Laffin, Ottó Berkesi, László Hajba

Bibliographic record

VenueJournal of Raman Spectroscopy · 2008
Typearticle
Languageen
FieldChemistry
TopicElectrochemical Analysis and Applications
Canadian institutionsUniversity of Calgary
FundersNatural Sciences and Engineering Research Council of CanadaNational Research FoundationUniversity of Calgary
KeywordsChemistryPalladiumAqueous solutionPlatinumRaman spectroscopyIonMoleculeLigand (biochemistry)Infrared spectroscopyDensity functional theoryCrystallographyInorganic chemistryAnalytical Chemistry (journal)Physical chemistryComputational chemistryCatalysisOrganic chemistry

Abstract

fetched live from OpenAlex

Abstract Mid infrared, far‐infrared and Raman spectroscopic studies, combined with force field analyses, were performed for the hydrated platinum(II) and palladium(II) ions and cis ‐diammineplatinum(II) complex in acidic aqueous solutions. Simplified Density Functional Theory (DFT) calculations were made for the equatorial plane of the platinum complexes. Careful subtraction of solvent spectra allowed a number of ‘internal’ modes of coordinated H 2 O and NH 3 to be determined as weak residual bands. The [Pt(OH 2 ) 6 ] 2+ and [ cis ‐Pt(NH 3 ) 2 (OH 2 ) 4 ] 2+ complexes were found to be six‐coordinated with four ligands strongly bound in an equatorial plane. The assignments of the vibrational modes in the equatorial plane could be performed on the basis of the experimental observations and by comparison with metal–ligand vibrations of square‐planar complexes, aided by normal coordinate calculations. For the weakly coordinated axial aqua ligands, the low wavenumber range and the polarizibility properties allowed the assignments of the bands at about 365 and 325 cm −1 to the stretching modes of one short and one longer Pt — O* bound to axial aqua ligands, respectively. A similar picture with even less strongly bound axial water molecules emerges from Raman spectroscopy data for the hydrated palladium(II) ion, [Pd(OH 2 ) 6 ] 2+ . The results are consistent with a description of the [Pt(OH 2 ) 6 ] 2+ and [Pd(OH 2 ) 6 ] 2+ aqua ions in C 4 v symmetry, and with the [ cis ‐Pt(NH 3 ) 2 (OH 2 ) 4 ] 2+ complex in the C s point group, and also in qualitative agreement with the structures devised from previous extended X‐ray absorption fine structure (EXAFS) measurements. Copyright © 2008 John Wiley &amp; Sons, Ltd.

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 score0.007
Threshold uncertainty score0.912

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.001
Science and technology studies0.0010.000
Scholarly communication0.0000.000
Open science0.0000.000
Research integrity0.0000.001
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 head0.237
Teacher spread0.225 · 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

Citations12
Published2008
Admission routes2
Has abstractyes

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