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Record W4282834819 · doi:10.21474/ijar01/14756

HYDROGEN PHENYLPHOSPHONATE PHENYLPHOSPHONIC ACID WATER 1:1:1 CO-CRYSTAL AND HYDROGEN PHENYLARSONATE CYCLOHEXYLAMMONIUM SALTS: SYNTHESIS AND CRYSTAL ELUCIDATION

2022· article· en· W4282834819 on OpenAlex

Why this work is in the frame

A frame that forgets how it found something cannot be audited. These are the routes that admitted this work.

fundA Canadian funder is recorded on the work.
no affNo Canadian affiliation: this work is invisible to an affiliation-only frame.
No Canadian affiliation. An affiliation-only frame, the usual design, would never have seen this work. It is one of the works that make the case for inverting the frame.

Bibliographic record

VenueInternational Journal of Advanced Research · 2022
Typearticle
Languageen
FieldEnvironmental Science
TopicChemical Synthesis and Characterization
Canadian institutionsnot available
FundersUniversité de BordeauxUniversité de Montréal
KeywordsHydrogen bondMonoclinic crystal systemChemistryCrystallographyCrystal structureMoleculeSalt (chemistry)Inorganic chemistryOrganic chemistry

Abstract

fetched live from OpenAlex

One pot reactions of phenylphosphonic acid or phenylarsonic acid with cyclohexylamine led to two new organic-inorganic hybrid salts [C6H14N][C6H5PO3H.C6H5PO3H2.H2O] (1) and [(C6H14N)(C6H5AsO3H)] (2) which were investigated by single-crystal X-ray diffraction analysis. Salt 1 crystallizes in the monoclinic system, space group P21/nwith a = 12.3963 (4), b = 6.1123 (2), c = 28.2081 (8) Å, β = 90.426 (1)°, V = 2137.27 (12)Å3 and Z = 4. Salt 2 crystallizes in the monoclinic system, space group P21/c with a = 12.3991 (5), b = 6.5048 (2), c = 18.5466 (7) Å, β = 105.824 (2)°, V = 1439.16 (9) Å3 and Z = 4. In the co-crystal 1, the hydrogen phenylphosphonate anions are organized into dimers via O–H···O H-bonds, whereas the phenylphosphonic acid and the water molecules are connected, through Owater–H···O and O–H···O hydrogen bonding interactions, to form dimers. Inter-species O–H···O hydrogen bonds connect the alternating dimers into anionic infinite chains. The 1D infinite ribbons are linked into an anionic 2D layer-like structure, by means of water molecules through Owater–H···O and O–H···Owater. The cyclohexylammonium interacts via N–H···O hydrogen bonds, to consolidate the compactness of the 2D layer-like structure. In the crystal of salt 2, the hydrogen phenylarsonate anions are organized into dimers through O–H···O H-bonds. Hydrogen bonded dimers are connected by the cyclohexylammoniumcations, through N–H···O hydrogen bonds, leading to the formation of an infinite ribbon. The 1D hydrogen bonded ribbons are interlinked through N–H···O hydrogen bonding interactions giving rise to a 2D layer-like structure.

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.

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)0.002
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 score0.025
Threshold uncertainty score0.997

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0020.000
Meta-epidemiology (narrow)0.0000.000
Meta-epidemiology (broad)0.0000.000
Bibliometrics0.0000.000
Science and technology studies0.0000.000
Scholarly communication0.0000.001
Open science0.0010.001
Research integrity0.0000.001
Insufficient payload (model declined to judge)0.0040.000

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 head0.282
Teacher spread0.270 · 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