Evidence map›Paper›PMID 42262571›Full record

ArticleJournal of molecular modeling2026

Theoretical study of electric field effects on C-C bond vibrations and optical behavior of acrylonitrile.

Muhammad Kashif Majeed, Muhammad Idrees, M Umar Majeed, Muhammad Adil Mansoor

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Article in Journal of molecular modeling, 2026. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Not yet cited in PubMed.

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0cells of the map it votes in
0citing 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

0 citing papers in PubMed.

No citing paper in PubMed yet.

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

4 authors.

Muhammad Kashif MajeedEric Jonsson School of Engineering, University of Texas at Dallas, Richardson, TX, 75080, USA. kashifmajeed96@gmail.com.
Muhammad IdreesState Key Laboratory Cultivation Base of Atmospheric Optoelectronic Detection and Information Fusion, Nanjing University of Information Science & Technology, Nanjing, 210044, China.
M Umar MajeedState Key Laboratory Cultivation Base of Atmospheric Optoelectronic Detection and Information Fusion, Nanjing University of Information Science & Technology, Nanjing, 210044, China. umarmajeed1516@yahoo.com.
Muhammad Adil MansoorDepartment of Chemistry, School of Natural Sciences, National University of Sciences and Technology, Islamabad, 44000, Pakistan.

Funding

No grant is acknowledged in the PubMed record.

6 · The paper itself

Abstract

contextExternal electric fields (EEFs) can significantly influence the structure, stability, and spectroscopic properties of polar conjugated molecules, serving as a controlled model for electrostatic effects in chemically relevant environments. In this study, acrylonitrile was examined to understand how an oriented EEF affects its C

methodsThe electronic, structural, and spectroscopic properties of Acrylonitrile were systematically investigated using density functional theory (DFT). Geometry optimization and property calculations were conducted at the B3LYP/6-311G(d,p) level under EEFs applied along the molecular axis. The study evaluated field-dependent total energies, dipole moments, frontier orbital energies, and variations in bond lengths, with potential energy scans used to explore changes in the C

Indexed as

AcrylonitrileDFTDissociationEEFIR spectrum

Identifiers

PMID42262571

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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.