Is It Conjugated or Not? The Theoretical and Experimental Electron Density Map of Bonding in <i>p</i>-CH<sub>3</sub>CH<sub>2</sub>COC<sub>6</sub>H<sub>4</sub>-C≡C-C≡C-<i>p</i>-C<sub>6</sub>H<sub>4</sub>COCH<sub>3</sub>CH<sub>2</sub>

Is It Conjugated or Not? The Theoretical and Experimental Electron Density Map of Bonding in <i>p</i>-CH<sub>3</sub>CH<sub>2</sub>COC<sub>6</sub>H<sub>4</sub>-C≡C-C≡C-<i>p</i>-C<sub>6</sub>H<sub>4</sub>COCH<sub>3</sub>CH<sub>2</sub>

The electron density of <i>p</i>-CH<sub>3</sub>CH<sub>2</sub>COC<sub>6</sub>H<sub>4</sub>-C≡CC≡C-<i>p</i>-C<sub>6</sub>H<sub>4</sub>COCH<sub>3</sub>CH<sub>2</sub> has been investig...

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Bibliographic Details
Main Authors: Przemysław Starynowicz, Sławomir Berski, Nurbey Gulia, Karolina Osowska, Tadeusz Lis, Sławomir Szafert
Format: Article
Language:English
Published: MDPI AG 2020-09-01
Series:Molecules
Subjects:
polyynes
density map
single-crystal X-ray diffraction
theoretical calculations
electron localization function
Online Access:https://www.mdpi.com/1420-3049/25/19/4388

Internet

https://www.mdpi.com/1420-3049/25/19/4388

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