Structural flexibility of 4,4′-methylene diphenyl diisocyanate (4,4′-MDI): evidence from first principles calculations

A reactant used globally in the production of polyurethane is the molecule 4,4′-methylene diphenyl diisocyanate (4,4′-MDI). The structural flexibility of 4,4′-MDI is one of the most important molecular properties influencing the polymerization process and this property was therefore modeled using de...

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Detalles Bibliográficos
Autores principales: Rodziewicz, Pawel, Goclon, Jakub
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer Berlin Heidelberg 2014
Materias:
Original Paper
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3936137/
https://www.ncbi.nlm.nih.gov/pubmed/24522379
http://dx.doi.org/10.1007/s00894-014-2097-8

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3936137/
https://www.ncbi.nlm.nih.gov/pubmed/24522379
http://dx.doi.org/10.1007/s00894-014-2097-8

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