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Academic Journal

py.Aroma: An Intuitive Graphical User Interface for Diverse Aromaticity Analyses

Subjects: aromaticity; NICS; ICSS

  • Source: Chemistry, Vol 6, Iss 6, Pp 1692-1703 (2024)

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Academic Journal

Too Persistent to Resist: Aromaticity in 16e Osmapentalene Radicals Survives Regardless of Redox

Subjects: aromaticity; metal-centered radical; DFT calculation

  • Source: Chemistry, Vol 7, Iss 1, p 22 (2025)

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Academic Journal

A New Set of Aromaticity Descriptors Based on the Electron Density Employing the Distributed Multipole Analysis (DMA)

Subjects: Chemistry; QD1-999

  • Source: ACS Omega, Vol 10, Iss 14, Pp 14157-14175 (2025)

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Academic Journal

How the Orientation of BN Units Influences the Aromaticity of Some Iminobora-Benzenes

Subjects: Chemistry; QD1-999

  • Source: ACS Omega, Vol 10, Iss 6, Pp 5900-5908 (2025)

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Academic Journal

Optimizing Aromaticity for Graphitization

Subjects: Chemistry; QD1-999

  • Source: ACS OmegaACS Omega, Vol 9, Iss 37, Pp 38462-38466 (2024)

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Academic Journal

Aromaticity of aza aromatic molecules: prediction from Hückel theory with modified parameters

Subjects: Hückel theory; aza aromatic molecule; HuLiS software

  • Source: Química Nova, Vol 46, Iss 4, Pp 319-328 (2023)

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Academic Journal

Electronic Structure, Aromaticity, and Magnetism of Minimum-Sized Regular Dodecahedral Endohedral Metallofullerenes Encapsulating Rare Earth Atoms

Subjects: Chemistry; QD1-999

  • Source: ACS OmegaACS Omega, Vol 9, Iss 32, Pp 35197-35208 (2024)

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Academic Journal

Theoretical Study on the Structures, Electronic Properties, and Aromaticity of Thiophene Analogues of Anti-Kekulene

Subjects: Chemistry; cyclobutadiene; macrocycles

  • Source: Chemistry, Vol 4, Iss 4, Pp 1546-1560 (2022)Chemistry; Volume 4; Issue 4; Pages: 1546-1560

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Academic Journal

In Silico Analysis of the Aromaticity of Some Carbo-Metallabenzenes and Carbo-Dimetallabenzenes (Carbo-mers Proposed from Metallabenzenes)

Subjects: Chemistry; QD1-999

  • Source: ACS OmegaACS Omega, Vol 9, Iss 9, Pp 10913-10928 (2024)

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Academic Journal

A DFT study of the chemical bonding properties, aromaticity indexes and molecular docking study of some phenylureas herbicides

Subjects: Chemistry; electronic delocalization; mulliken atomic charge

  • Source: Journal of the Serbian Chemical Society, Vol 89, Iss 9, Pp 1165-1176 (2024)

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  • 1-10 of  559 results for ""Aromaticity""