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Record W2050544296 · doi:10.1039/b300951c

Chiral hexarhodium carbonyl clusters containing heterobidentate phosphine ligands; a structural and reactivity study

2003· article· en· W2050544296 on OpenAlexaff
Sergey P. Tunik, Igor O. Koshevoy, Anthony J. Poë, David H. Farrar, Ebbe Nordlander, Matti Haukka, Tapani A. Pakkanen

Bibliographic record

VenueDalton Transactions · 2003
Typearticle
Languageen
FieldChemistry
TopicMolecular spectroscopy and chirality
Canadian institutionsUniversity of Toronto
Fundersnot available
KeywordsPhosphineRhodiumChemistryDenticityCrystallographyPhenylphosphineStereochemistryCrystal structureCatalysisOrganic chemistry

Abstract

fetched live from OpenAlex

Some intrinsically chiral [Rh6(CO)14(μ,κ2-PX)] clusters have been synthesized, beginning with reactions of [Rh6(CO)16−x(NCMe)x] (x = 1, 2) with PX, where PX represents the bidentate bridging ligands diphenyl(benzothienyl)phosphine (1), diphenyl(2-thienyl)phosphine (2), di(2-thienyl)phenylphosphine (3), tris(2-thienyl)phosphine (4), diphenyl(2-pyridyl)phosphine (5) and diphenylvinylphosphine (6). The ligand tris(2-furyl)phosphine (7) shows no bridging capability. When x = 1 the initial products are the clusters [Rh6(CO)15(κ1-PX)] which undergo spontaneous CO loss to form [Rh6(CO)14(μ,κ2-PX)]. The structures of the [Rh6(CO)15(κ1-PX)] clusters have been elucidated by IR, NMR spectroscopy and FAB-MS spectrometry, and have been found to involve phosphorus atom coordination to a rhodium atom. In addition, the solid state structures of the [Rh6(CO)14(μ,κ2-Ph2P(2-benzothienyl))] (8), [Rh6(CO)14(μ,κ2-Ph2P(2-thienyl))] (9), [Rh6(CO)14(μ,κ2-PhP(2-thienyl)2)] (10) and [Rh6(CO)14(μ,κ2-Ph2P(pyridyl))] (12) clusters have been determined by X-ray crystallography. The various types of chirality exhibited by these clusters are discussed. A simple model is proposed to account for the ratios of stereochemical isomers found in the Rh6(CO)14(μ,κ2-PhP(2-thienyl)2 cluster. The kinetics of formation of the bridged clusters from the monosubstituted [Rh6(CO)15(κ1-PX)] clusters have been 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 categoriesMeta-epidemiology (narrow)
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 score0.074
Threshold uncertainty score1.000

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 head0.011
GPT teacher head0.260
Teacher spread0.249 · 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

Citations44
Published2003
Admission routes1
Has abstractyes

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