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Record W2939055012 · doi:10.1017/s0885715615000329

Crystal structure of solifenacin hydrogen succinate, C <sub>23</sub> H <sub>27</sub> N <sub>2</sub> O <sub>2</sub> (HC <sub>4</sub> H <sub>4</sub> O <sub>4</sub> )

2015· article· en· W2939055012 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.

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

Bibliographic record

VenuePowder Diffraction · 2015
Typearticle
Languageen
FieldMaterials Science
TopicX-ray Diffraction in Crystallography
Canadian institutionsCanadian Light Source (Canada)
FundersArgonne National LaboratoryBasic Energy SciencesOffice of ScienceAstellas PharmaU.S. Department of Energy
KeywordsHydrogen bondCrystallographyMoleculeCrystal structureHydrogenMaterials scienceCrystal (programming language)X-ray crystallographyChemistryDiffractionPhysicsOrganic chemistryOptics

Abstract

fetched live from OpenAlex

The crystal structure of solifenacin hydrogen succinate [C 23 H 27 N 2 O 2 (HC 4 H 4 O 4 )] has been solved and refined using synchrotron X-ray powder diffraction data, and optimized using density functional techniques. Solifenacin hydrogen succinate crystallizes in space group P 2 1 (#4) with a = 6.477 03(2), b = 7.830 95(2), c = 23.848 72(7) Å, β = 90.2373(3)°, V = 1209.63(1) Å 3 , and Z = 2. The hydrogen succinate anions form a chain linked by strong hydrogen bonds parallel to the a -axis. Discrete N–H···O hydrogen bonds lie on the sides of this chain, resulting in a layer parallel to the ab -plane rich in hydrogen bonds. Halfway between these layers the molecules meet in a herringbone packing of aromatic rings. The powder pattern has been submitted to ICDD for inclusion in future releases of the Powder Diffraction File™.

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)0.007
metaresearch head score (Gemma)0.004
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Science and technology studies, Scholarly communication, Open science, Research integrity, Insufficient payload (model declined to judge)
Consensus categoriesMeta-epidemiology (narrow), Science and technology studies, 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 score0.019
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0070.004
Meta-epidemiology (narrow)0.0090.010
Meta-epidemiology (broad)0.0080.005
Bibliometrics0.0070.009
Science and technology studies0.0040.004
Scholarly communication0.0030.012
Open science0.0060.003
Research integrity0.0070.008
Insufficient payload (model declined to judge)0.0000.004

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 head0.015
GPT teacher head0.237
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