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Record W2953046871 · doi:10.1021/ic400805c

Synthesis of [N(CH<sub>3</sub>)<sub>4</sub>]<sub>2</sub>O<sub>3</sub>SOSO<sub>2</sub>(s) and [N(CH<sub>3</sub>)<sub>4</sub>]<sub>2</sub>[(O<sub>2</sub>SO)<sub>2</sub>SO<sub>2</sub>]·SO<sub>2</sub>(s) Containing (SO<sub>4</sub>)(SO<sub>2</sub>)<sub><i>x</i></sub><sup>2–</sup><i>x</i>= 1, 2, Members of a New Class of Sulfur Oxydianions

2013· article· en· W2953046871 on OpenAlex
Pablo J. Bruna, A. Decken, Friedrich Grein, Jack Passmore, J. Mikko Rautiainen, Stephanie Richardson, Tom K. Whidden

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.

affAt least one author lists a Canadian institution in the pinned OpenAlex snapshot.

Bibliographic record

VenueInorganic Chemistry · 2013
Typearticle
Languageen
FieldMaterials Science
TopicSolid-state spectroscopy and crystallography
Canadian institutionsAtlantic Hydrogen (Canada)University of New Brunswick
Fundersnot available
KeywordsChemistryRaman spectroscopySulfurCrystallographyInfrared spectroscopyInfraredStereochemistryOrganic chemistry

Abstract

fetched live from OpenAlex

One mole equivalent of SO2 reversibly reacts with [N(CH3)4]2SO4(s) to give [N(CH3)4]2S2O6(s) (1) containing the [O3SOSO2](2-), shown by Raman and IR to be an isomer of the [O3SSO3](2-) dianion. The experimental and calculated (B3PW91/6-311+G(3df)) vibrational spectra are in excellent agreement, and the IR spectrum is similar to that of the isoelectronic O3ClOClO2. Crystals of [N(CH3)4]2(O2SO)2SO2·SO2 (2) were isolated from solutions of [N(CH3)4]2SO4 in liquid SO2. The X-ray structure showed that 2 contained the [(O2SO)2SO2](2-) dianion. The characterized N(CH3)4(+) salts 1 and 2 are the first two members of the (SO4)(SO2)x(2-) class of sulfur oxydianions analogous to the well-known small cation salts of the SO4(SO3)x(2-) polysulfates.

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)0.021
metaresearch head score (Gemma)0.014
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMetaresearch, Meta-epidemiology (narrow), Meta-epidemiology (broad), Bibliometrics, Science and technology studies, Scholarly communication, Open science, Research integrity, Insufficient payload (model declined to judge)
Consensus categoriesMeta-epidemiology (narrow), Meta-epidemiology (broad), Bibliometrics, Science and technology studies, Scholarly communication, Open science, Research integrity
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 score0.035
Threshold uncertainty score0.996

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0210.014
Meta-epidemiology (narrow)0.0340.040
Meta-epidemiology (broad)0.0340.019
Bibliometrics0.0150.033
Science and technology studies0.0160.026
Scholarly communication0.0120.018
Open science0.0260.017
Research integrity0.0240.028
Insufficient payload (model declined to judge)0.0010.008

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 head0.008
GPT teacher head0.213
Teacher spread0.205 · 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