Evidence map›Paper›PMID 33844880›Full record

ArticleAngewandte Chemie (International ed. in English)2021

Highs and Lows of Bond Lengths: Is There Any Limit?

Alvaro Lobato, Miguel A Salvadó, J Manuel Recio, Mercedes Taravillo, Valentín G Baonza

Abstract read
In one paragraph

Article in Angewandte Chemie (International ed. in English), 2021. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 10 papers.

0numbers the graph read from it
0cells of the map it votes in
10citing 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

10 citing papers in PubMed.

  1. Self-Healing Starch-Based Ionogels with Hydroneutral Dipole-Dipole Interactions.Advanced science (Weinheim, Baden-Wurttemberg, Germany) · 2026
    Article
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  9. Extremely Long C-C Bonds Predicted beyond 2.0 Å.The journal of physical chemistry. A · 2023
    Article
  10. Highs and Lows of Bond Lengths: Is There Any Limit?Angewandte Chemie (International ed. in English) · 2021
    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

5 authors.

Alvaro LobatoMalta-Consolider Team and Departamento de Química Física, Universidad Complutense de Madrid, Av. Complutense s/n, 28040, Madrid, Spain.ORCID http://orcid.org/0000-0002-2798-6178
Miguel A SalvadóMALTA-Consolider Team and Departamento de Química Física y Analítica, Universidad de Oviedo, Av. Julián Clavería, 8, 33006, Oviedo, Spain.ORCID http://orcid.org/0000-0003-1411-8539
J Manuel RecioMALTA-Consolider Team and Departamento de Química Física y Analítica, Universidad de Oviedo, Av. Julián Clavería, 8, 33006, Oviedo, Spain.ORCID http://orcid.org/0000-0002-3182-7508
Mercedes TaravilloMalta-Consolider Team and Departamento de Química Física, Universidad Complutense de Madrid, Av. Complutense s/n, 28040, Madrid, Spain.ORCID http://orcid.org/0000-0003-1159-8530
Valentín G BaonzaMalta-Consolider Team and Departamento de Química Física, Universidad Complutense de Madrid, Av. Complutense s/n, 28040, Madrid, Spain.ORCID http://orcid.org/0000-0001-9994-0980

Funding

Agencia Estatal de Investigación PGC2018-094814-B-C21Agencia Estatal de Investigación PGC2018-094814-B-C22Agencia Estatal de Investigación RED2018-102612-TGobierno del Principado de Asturias FC-GRUPIN-IDI/2018/000177
6 · The paper itself

Abstract

Two distinct points on the potential energy curve (PEC) of a pairwise interaction, the zero-energy crossing point and the point where the stretching force constant vanishes, allow us to anticipate the range of possible distances between two atoms in diatomic, molecular moieties and crystalline systems. We show that these bond-stability boundaries are unambiguously defined and correlate with topological descriptors of electron-density-based scalar fields, and can be calculated using generic PECs. Chemical databases and quantum-mechanical calculations are used to analyze a full set of diatomic bonds of atoms from the s-p main block. Emphasis is placed on the effect of substituents in C-C covalent bonds, concluding that distances shorter than 1.14 Å or longer than 2.0 Å are unlikely to be achieved, in agreement with ultra-high-pressure data and transition-state distances, respectively. Presumed exceptions are used to place our model in the correct framework and to formulate a conjecture for chained interactions, which offers an explanation for the multimodal histogram of O-H distances reported for hundreds of chemical systems.

Indexed as

bond lengthcarbon-carbon bondsELF (electron localization function)hydrogen bondspotential energy curve

Identifiers

PMID33844880
PMCPMC8362100

What OpenQuestion holds

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LicenceCC BY-NC-ND
Read underepoch 390

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.