Evidence map›Paper›PMID 33507084›Full record

ArticleThe journal of physical chemistry letters2021

Switching Hydrogen Bonding to π-Stacking: The Thiophenol Dimer and Trimer.

Rizalina Tama Saragi, Marcos Juanes, Cristóbal Pérez, Pablo Pinacho, Denis S Tikhonov, Walther Caminati, Melanie Schnell, Alberto Lesarri

Abstract read
In one paragraph

Article in The journal of physical chemistry letters, 2021. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 11 papers.

0numbers the graph read from it
0cells of the map it votes in
11citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

11 citing papers in PubMed.

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  10. Double Proton Transfer Across a Table: The Formic Acid Dimer-Fluorobenzene Complex.Angewandte Chemie (International ed. in English) · 2021
    Article
  11. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

8 authors.

Rizalina Tama SaragiDepartamento de Química Física y Química Inorgánica, Facultad de Ciencias-I.U. CINQUIMA, Universidad de Valladolid, Paseo de Belén, 7, E-47011 Valladolid, Spain.ORCID http://orcid.org/0000-0003-4472-357X
Marcos JuanesDepartamento de Química Física y Química Inorgánica, Facultad de Ciencias-I.U. CINQUIMA, Universidad de Valladolid, Paseo de Belén, 7, E-47011 Valladolid, Spain.ORCID http://orcid.org/0000-0002-7257-8632
Cristóbal PérezDeutsches Elektronen-Synchrotron DESY, Notkestraße 85, D-22607 Hamburg, Germany.ORCID http://orcid.org/0000-0001-5248-5212
Pablo PinachoDeutsches Elektronen-Synchrotron DESY, Notkestraße 85, D-22607 Hamburg, Germany.ORCID http://orcid.org/0000-0002-6369-4631
Denis S TikhonovDeutsches Elektronen-Synchrotron DESY, Notkestraße 85, D-22607 Hamburg, Germany.
Walther CaminatiDipartimento di Chimica Giacomo Ciamician, Via Selmi, 2, I-40126 Bologna, Italy.ORCID http://orcid.org/0000-0002-1845-3759
Melanie SchnellDeutsches Elektronen-Synchrotron DESY, Notkestraße 85, D-22607 Hamburg, Germany.ORCID http://orcid.org/0000-0001-7801-7134
Alberto LesarriDepartamento de Química Física y Química Inorgánica, Facultad de Ciencias-I.U. CINQUIMA, Universidad de Valladolid, Paseo de Belén, 7, E-47011 Valladolid, Spain.ORCID http://orcid.org/0000-0002-0646-6341

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

We used jet-cooled broadband rotational spectroscopy to explore the balance between π-stacking and hydrogen-bonding interactions in the self-aggregation of thiophenol. Two different isomers were detected for the thiophenol dimer, revealing dispersion-controlled π-stacked structures anchored by a long S-H···S sulfur hydrogen bond. The weak intermolecular forces allow for noticeable internal dynamics in the dimers, as tunneling splittings are observed for the global minimum. The large-amplitude motion is ascribed to a concerted inversion motion between the two rings, exchanging the roles of the proton donor and acceptor in the thiol groups. The determined torsional barrier of

Identifiers

PMID33507084
PMCPMC8812119

What OpenQuestion holds

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Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.