MétaCan
Menu
Back to cohort
Record W1969138164 · doi:10.1107/s0108270102020036

Solvent–metal interactions in bis[1,2-dicarba-<i>closo</i>-dodecaboran(12)-1-yl]mercury(II) dichloromethane solvate and bis[1,12-dicarba-<i>closo</i>-dodecaboran(12)-1-yl]mercury(II) tetrahydrofuran solvate

2002· article· en· W1969138164 on OpenAlexaff
Pierre Morel, Paul Schaffer, James F. Britten, John F. Valliant

Bibliographic record

VenueActa Crystallographica Section C Crystal Structure Communications · 2002
Typearticle
Languageen
FieldMedicine
TopicBoron Compounds in Chemistry
Canadian institutionsMcMaster University
Fundersnot available
KeywordsChemistryDichloromethaneCarboraneMercury (programming language)SolventFuranMoleculeMetalMedicinal chemistryCrystallographyStereochemistryOrganic chemistry

Abstract

fetched live from OpenAlex

The title compounds, bis[1,2-dicarba-closo-dodecaboran(12)-1-yl]mercury(II) dichloromethane solvate, [Hg(C(2)B(10)H(11))(2)].CH(2)Cl(2), (I), and bis[1,12-dicarba-closo-dodecaboran(12)-1-yl]mercury(II) tetrahydrofuran solvate, [Hg(C(2)B(10)H(11))(2)].C(4)H(8)O, (II), were prepared in excellent yields using a robust synthetic procedure involving the reaction of HgCl(2) with the appropriate monolithiocarborane. X-Ray analysis of the products revealed strong interactions between the Hg atoms in both complexes and the respective lattice solvent. The distances between the Hg(II) centers and the Cl atoms of the dichloromethane solvent molecule in the ortho-carborane derivative, (I), and the O atom of the tetrahydrofuran molecule in the para-carborane complex, (II), are shorter than the sums of the van der Waals radii for Hg and Cl (3.53 A), and Hg and O (3.13 A), respectively, indicating moderately strong interactions. There are two crystallographically independent molecules in the asymmetric unit of both compounds, which, in each case, are related by differing relative positions of the cages.

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)0.001
metaresearch head score (Gemma)0.001
Version: codex-gemma-dda1882f352aValidation status: machine_predicted_unvalidated
Candidate categoriesMeta-epidemiology (narrow), Science and technology studies, Research integrity, Insufficient payload (model declined to judge)
Consensus categoriesMeta-epidemiology (narrow), Research integrity
DomainCandidate signal: none · Consensus signal: none
Study designCandidate signal: Bench or experimental · Consensus signal: none
GenreCandidate signal: Empirical · Consensus signal: Empirical
Teacher disagreement score0.964
Threshold uncertainty score1.000

Codex and Gemma teacher scores by category

CategoryCodexGemma
Metaresearch0.0010.001
Meta-epidemiology (narrow)0.0020.002
Meta-epidemiology (broad)0.0020.001
Bibliometrics0.0020.005
Science and technology studies0.0030.002
Scholarly communication0.0000.002
Open science0.0030.002
Research integrity0.0010.006
Insufficient payload (model declined to judge)0.0020.000

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 head0.029
GPT teacher head0.277
Teacher spread0.249 · 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

Citations7
Published2002
Admission routes1
Has abstractyes

Explore more

Same venueActa Crystallographica Section C Crystal Structure CommunicationsSame topicBoron Compounds in ChemistryFrench-language works237,207