MétaCan
Menu
Back to cohort
Record W2409343170 · doi:10.1002/slct.201600245

Thiacalix[4]arene Derivatives Bearing Imidazole Units: A Ditopic Hard/Soft Receptor for Na <sup>+</sup> and K <sup>+</sup> /Ag <sup>+</sup> with an Allosteric Effect and a Reusable Extractant for Dichromate Anions

2016· article· en· W2409343170 on OpenAlexaff
Jiang‐Lin Zhao, Chong Wu, Xi Zeng, Shofiur Rahman, Paris E. Georghiou, M.R.J. Elsegood, Mr. Thomas G. Warwick, Carl Redshaw, Simon J. Teat, Takehiko Yamato

Bibliographic record

VenueChemistrySelect · 2016
Typearticle
Languageen
FieldChemistry
TopicMolecular Sensors and Ion Detection
Canadian institutionsMemorial University of Newfoundland
FundersEngineering and Physical Sciences Research Council
KeywordsImidazoleChemistryTitrationProton NMRAqueous solutionStereochemistryMedicinal chemistryAllosteric regulationMetal ions in aqueous solutionTetraIonCrystallographyReceptorPhysical chemistryOrganic chemistry

Abstract

fetched live from OpenAlex

Abstract Two novel receptors 5,11,17,23‐tetra‐tert‐butyl‐25,27‐bis[(ethoxycarbonyl)methoxy]‐26,28‐bis‐[1‐methyl‐(imidazole)meth‐oxy]‐2,8,14,20‐tetra‐thiacalix[4]arene ( L1 ) and 5,11,17,23‐tetra‐tert‐butyl‐25,27‐bis‐[(benzyl)methoxy]‐26,28‐bis‐[1‐methyl‐(imidazole)‐methoxy]‐2,8,14,20‐tetrathiacalix[4]arene ( L2 ) possessing imidazole moieties based on thiacalix[4]arene in the 1,3‐ alternate conformation have been synthesized and characterized. The crystal structures of L1 and L2 have been determined. The binding behaviour towards Li + , Na + , K + and Ag + ions has been examined by 1 H NMR titration experiments in (CDCl 3 /CD 3 CN; 10:1, v/v) solution. The exclusive formation of mononuclear complexes of L1 with metal cations is of particular interest revealing a negative allosteric effect in the thiacalix[4]arene family. Liquid‐liquid extraction experiments indicate that synthesized L2 can be utilized as an efficient reusable extractant for dichromate anion by controlling the pH of the aqueous solution.

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 score0.001
Threshold uncertainty score0.004

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 science0.0000.000
Research integrity0.0000.000
Insufficient payload (model declined to judge)0.0010.001

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 head0.230
Teacher spread0.218 · 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

Citations7
Published2016
Admission routes1
Has abstractyes

Explore more

Same venueChemistrySelectSame topicMolecular Sensors and Ion DetectionFrench-language works237,207