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

The electron density of p-CH(3)CH(2)COC(6)H(4)-C≡CC≡C-p-C(6)H(4)COCH(3)CH(2) has been investigated on the basis of single-crystal X-ray diffraction data collected to high resolution at 100 K and from theoretical calculations. An analysis of the X-ray data of the diyne showed interesting “liquidity”...

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Detalles Bibliográficos
Autores principales: Starynowicz, Przemysław, Berski, Sławomir, Gulia, Nurbey, Osowska, Karolina, Lis, Tadeusz, Szafert, Sławomir
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2020
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7583911/
https://www.ncbi.nlm.nih.gov/pubmed/32987740
http://dx.doi.org/10.3390/molecules25194388

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7583911/
https://www.ncbi.nlm.nih.gov/pubmed/32987740
http://dx.doi.org/10.3390/molecules25194388

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