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Record W2087922240 · doi:10.1080/10587250108025038

Crystal Structure of 1-Hexyl-4-(4-Isothio-Cyantophenyl) Bicyclo[2,2,2] Octane

2001· article· en· W2087922240 on OpenAlexfundno aff
N.K. Lokanath, D. Revannasiddaiah, M. A. Sridhar, J. Shashidhara Prasad

Bibliographic record

VenueMolecular crystals and liquid crystals science technology. Section A, Molecular crystals and liquid crystals/Molecular crystals and liquid crystals science and technology. Section A, Molecular crystals and liquid crystals · 2001
Typearticle
Languageen
FieldChemistry
TopicAsymmetric Synthesis and Catalysis
Canadian institutionsnot available
FundersDalhousie UniversityDepartment of Science and Technology, Ministry of Science and Technology, IndiaNipissing University
KeywordsTriclinic crystal systemOctaneBicyclic moleculeCrystal structureCrystal (programming language)CrystallographyChemistryMaterials scienceStereochemistryOrganic chemistryComputer science

Abstract

fetched live from OpenAlex

Crystal structure of 1-hexyl-4-(4-isothiocyantophenyl)bicyclo2,2,2] octane C21H29NS, crystallises in the triclinic space group P (1) over bar with a = 20.821(9)Angstrom, b = 11,647(9)Angstrom, c = 9.904(4)Angstrom, alpha = 92.53(4)degrees, beta = 91.83(4)degrees, gamma = 116.96 degrees, V = 3968(3)Angstrom (3) Z = 8, D-(cal) = 1.090 Mg/m(3), mu = 0. 164 mm(-1), F-000 = 1424, R1 = 0, 10.

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)0.009
metaresearch head score (Gemma)0.004
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Bibliometrics, Science and technology studies, Scholarly communication, Research integrity
Consensus categoriesMeta-epidemiology (narrow), Bibliometrics, 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 score0.093
Threshold uncertainty score0.999

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0090.004
Meta-epidemiology (narrow)0.0070.007
Meta-epidemiology (broad)0.0080.002
Bibliometrics0.0140.021
Science and technology studies0.0070.023
Scholarly communication0.0040.005
Open science0.0050.007
Research integrity0.0060.005
Insufficient payload (model declined to judge)0.0010.000

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 head0.005
GPT teacher head0.224
Teacher spread0.218 · 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 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

Citations2
Published2001
Admission routes1
Has abstractyes

Explore more

Same venueMolecular crystals and liquid crystals science technology. Section A, Molecular crystals and liquid crystals/Molecular crystals and liquid crystals science and technology. Section A, Molecular crystals and liquid crystalsSame topicAsymmetric Synthesis and CatalysisFrench-language works237,207