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Record W3003185199 · doi:10.1107/s2414314620000401

Dichloridobis[2-(pyridin-2-yl-κ<i>N</i>)-1<i>H</i>-benzimidazole-κ<i>N</i> <sup>3</sup>]nickel(II) monohydrate

2020· article· en· W3003185199 on OpenAlexafffund
Connor S. MacNeil, Aloice O. Ogweno, Stephen O. Ojwach, Paul G. Hayes

Bibliographic record

VenueIUCrData · 2020
Typearticle
Languageen
FieldMedicine
TopicMetal complexes synthesis and properties
Canadian institutionsUniversity of Lethbridge
FundersNatural Sciences and Engineering Research Council of CanadaInyuvesi Yakwazulu-NataliPrinceton University
KeywordsChemistryBenzimidazoleIsostructuralCrystal structureNickelMoleculeHydrogen bondOctahedronSupramolecular chemistryCrystallographyStereochemistryCobaltDivalentChelationInorganic chemistryOrganic chemistry

Abstract

fetched live from OpenAlex

In the title complex, [NiCl 2 (C 12 H 9 N 3 ) 2 ]·H 2 O, a divalent nickel atom is coordinated by two 2-(pyridin-2-yl)-1 H -benzimidazole ligands in a slightly distorted octahedral environment defined by four N donors of two N , N ′-chelating ligands, along with two cis -oriented anionic chloride donors. The title complex crystallized with a water molecule disordered over two positions. In the crystal, a combination of O—H...Cl, O—H.·O and N—H...Cl hydrogen bonds, together with C—H...O, C—H...Cl and C—H...π interactions, links the complex molecules and the water molecules to form a supramolecular three-dimensional framework. The title complex is isostructural with the cobalt(II) dichloride complex reported previously [Das et al. (2011). Org. Biomol. Chem . 9 , 7097–7107].

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), Insufficient payload (model declined to judge)
Consensus categoriesInsufficient payload (model declined to judge)
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Not applicable · Consensus signal: Not applicable
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.328
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0000.000
Meta-epidemiology (narrow)0.0010.000
Meta-epidemiology (broad)0.0010.000
Bibliometrics0.0000.001
Science and technology studies0.0000.000
Scholarly communication0.0000.001
Open science0.0010.001
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0020.002

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 head0.071
GPT teacher head0.262
Teacher spread0.191 · 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; both teacher heads agree on what is shown here.

Study designNot applicable
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

Citations2
Published2020
Admission routes2
Has abstractyes

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