Evidence map›Paper›PMID 39556283›Full record

ArticleJournal of molecular modeling2024

Effect of structure and interaction on physicochemical properties of new [Emim][BF

Yuanhao Liao, Dongwei Sun, Xiaobo Tang, Sheng Han, Xingzong Dong, Bo Zhao, Yu An, Zhiqiang Yang, Nian Tang, Jijun Zeng and 1 more

Abstract read
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In one paragraph

Article in Journal of molecular modeling, 2024. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.

0numbers the graph read from it
0cells of the map it votes in
1citing 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

1 citing paper in PubMed.

  1. 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

11 authors.

Yuanhao LiaoState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Dongwei SunElectric Power Research Institute of Guangdong Power Grid, Guangzhou, 510080, China.
Xiaobo TangState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Sheng HanState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Xingzong DongState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Bo ZhaoState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Yu AnState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Zhiqiang YangState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China.
Nian TangElectric Power Research Institute of Guangdong Power Grid, Guangzhou, 510080, China.
Jijun ZengState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China. huajun_8484@163.com.
Wei ZhangState Key Laboratory of Fluorine & Nitrogen Chemicals, Xi'an Modern Chemistry Research Institute, Xi'an, 710065, China. zhangwei_204@163.com.

Funding

Key Research & Development Plan of Shaanxi province 2021ZDLGY13-07the Science and Technology Program of China Southern Power Grid GDKJXM20220361
6 · The paper itself

Abstract

contextOne of the key challenges in the industrial application of ionic liquids (ILs) is their extreme characteristics, such as viscosity, glass transition temperatures, and conductivity. Understanding the relationship between ILs structure and physicochemical property is a crucial aspect of the directed design of ILs with good properties, which is a prerequisite for their successful implementation in industrial processes. In this work, high-level quantum-chemical research with for four pairs ionic liquids, [Emim][X] and [Emim][BF

methodsQuantum chemistry calculations were performed under B3LYP-D3/aug-cc-pVTZ level of DFT functional using the Gaussian 16 package (version C01). The Multiwfn 3.7 program was used to calculate the electrostatic potential, interaction region indicator, the information of bond critical points, core-valence bifurcation index, and ADCH charge. Visualization of structure and the region of interaction were achieved using VESTA and VMD.

Indexed as

Charge transferIonic liquidIon interactionPhysicochemical propertySturcture

Identifiers

PMID39556283

What OpenQuestion holds

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Registered trials

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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.