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Record W2791104832 · doi:10.1002/slct.201703126

Confirmation of the Structure of <i>Trans</i> ‐Cyclic Azobenzene by X‐Ray Crystallography and Spectroscopic Characterization of Cyclic Azobenzene Analogs

2018· article· en· W2791104832 on OpenAlexafffund
Mee Sook Jun, Dhruval K. Joshi, Ravi Shekar Yalagala, Jesse Vanloon, Razvan Simionescu, Alan J. Lough, Heather L. Gordon, Hongbin Yan

Bibliographic record

VenueChemistrySelect · 2018
Typearticle
Languageen
FieldMaterials Science
TopicPhotochromic and Fluorescence Chemistry
Canadian institutionsUniversity of TorontoBrock University
FundersNatural Sciences and Engineering Research Council of Canada
KeywordsAzobenzenePhotoisomerizationPhotoswitchChemistryCis–trans isomerismCrystallographyX-ray crystallographyCrystal structureThermal stabilityMoleculeProton NMRIsomerizationStereochemistryDiffractionPhotochemistryOrganic chemistryOpticsPhysics

Abstract

fetched live from OpenAlex

Abstract The photoisomerization properties of a series of cyclic azobenzene (cAb) analogs, including non‐substituted, Br‐, CN‐, carboxyl‐, and amino cAb, were compared. While the trans ‐form of these analogs show different degrees of thermal stability, no spectral changes in the absorption wavelengths were observed for amino cAb upon exposure to purple light. The 15 N NMR chemical shifts of cAb in both cis ‐ and trans ‐forms were found to show a large difference from those of aromatic azobenzene; however, the trend of difference in chemical shift is in agreement with that obtained from quantum chemical calculations. More importantly, the structure of the photoisomerization product from cis ‐cAb was confirmed to be, indeed, the trans ‐cAb by X‐ray diffraction experiments. The 15 NMR data of the cAb isomers and confirmation of trans ‐cAb through crystal structure will be of importance for future studies in the design and applications of cAb as a photoswitch.

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 score0.005
Threshold uncertainty score0.626

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 head0.003
GPT teacher head0.196
Teacher spread0.193 · 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
Published2018
Admission routes2
Has abstractyes

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