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Record W6959541959 · doi:10.1021/ic049500+.s002

Self-Assembly Using Dynamic Coordination Chemistry and Hydrogen\nBonding:  Mercury(II) Macrocycles, Polymers and Sheets

2016· article· en· W6959541959 on OpenAlexaff

Bibliographic record

VenueFigshare · 2016
Typearticle
Languageen
FieldChemistry
TopicSupramolecular Chemistry and Complexes
Canadian institutionsWestern University
Fundersnot available
KeywordsPolymerHydrogen bondCoordination complexMoleculeAmideTetrahedronSolid-stateHydrogen

Abstract

fetched live from OpenAlex

The self-assembly of extended metal-containing arrays is described based on dynamic coordination chemistry at\nmercury(II) with bis(amidopyridyl) ligands to form macrocycles, polymers, or sheets which can be further organized\nby hydrogen bonding between amide substituents. The ligands 1,2-C<sub>6</sub>H<sub>4</sub>{NHC(O)-4-C<sub>5</sub>H<sub>4</sub>N}<sub>2</sub>, <b>1</b>, 1,2-C<sub>6</sub>H<sub>4</sub>{C(O)NHCH<sub>2</sub>-4-C<sub>5</sub>H<sub>4</sub>N}<sub>2</sub>, <b>2</b>, and 1,2-C<sub>6</sub>H<sub>4</sub>{CH<sub>2</sub>C(O)NHCH<sub>2</sub>-4-C<sub>5</sub>H<sub>4</sub>N}<sub>2</sub>, <b>3</b> can adopt polar conformations and so can confer\nhelicity in their complexes. Several macrocycles of formula [(HgX<sub>2</sub>)<sub>2</sub>(μ-LL)<sub>2</sub>] (LL = <b>1</b>, <b>2</b>), with tetrahedral mercury(II) centers, were prepared in which individual molecules are further self-assembled via hydrogen bonding in the\nsolid state to form one- or two-dimensional polymers or sheets. In one case, a one-dimensional polymer [{(HgX<sub>2</sub>)(μ-<b>3</b>)}<i><sub>n</sub></i>] was formed. It is shown that the mercury(II) centers can be six-coordinate in forming the sheet structure\n[{(HgX<sub>2</sub>)(μ-<b>2</b>)<sub>2</sub>}<i><sub>n</sub></i>], in which there are particularly large pores.

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 categoriesInsufficient payload (model declined to judge)
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 score0.027
Threshold uncertainty score0.974

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)0.0270.000

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 head0.013
GPT teacher head0.235
Teacher spread0.222 · 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

Citations0
Published2016
Admission routes1
Has abstractyes

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