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Record W3098333884 · doi:10.1139/cjc-2020-0351

Flexible coordination of carbodiphosphorane-based pincer ligands in chromium(0) carbonyl complexes

2020· article· en· W3098333884 on OpenAlexvenueno aff
Leon Maser, Philipp Korziniowski, Róbert Langer

Bibliographic record

VenueCanadian Journal of Chemistry · 2020
Typearticle
Languageen
FieldChemistry
TopicOrganometallic Complex Synthesis and Catalysis
Canadian institutionsnot available
Fundersnot available
KeywordsChemistryChromiumLigand (biochemistry)Medicinal chemistryIrradiationStereochemistryOrganic chemistry

Abstract

fetched live from OpenAlex

A series of chromium(0) complexes was obtained by subsequent irradiation of [Cr(CO)6] in the presence of [(Ph2P-CH2-PPh2)2CH]+. Depending on the reaction conditions and the duration of irradiation, complexes with different coordination modes of the potentially tridentate ligand can be isolated. Shorter irradiation times lead to the coordination of the terminal PPh2 groups and the formation of [(κ2P,P′-{Ph2P-CH2-PPh2}CH)Cr(CO)4]+ (2), whereas after longer irradiation duration, the formation of fac- and mer-[(κ3P,C,P′-{Ph2P-CH2-PPh2}CH)Cr(CO)3]+ (3) can be observed. In the presence of base, the neutral complex [(κ3P,C,P′-{Ph2P-CH2-PPh2}C)Cr(CO)3] (4) can be isolated, enabling the analysis of the central CDP group’s net donor strength through the C–O stretching vibration. Finally, the utilization of reductants like potassium graphite lead to the loss of hydrogen and generation of an anionic chromium(0) complex (5). Using quantum chemical methods, the stability of possible isomers is explored.

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)0.000
metaresearch head score (Gemma)0.000
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 score0.002
Threshold uncertainty score0.006

Distilled classifier scores by category (both heads)

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 science0.0000.001
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0020.000

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 head0.015
GPT teacher head0.205
Teacher spread0.190 · 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

Citations5
Published2020
Admission routes1
Has abstractyes

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