10.1021/cg300727r.s007
Rafel Prohens
Rafel
Prohens
Anna Portell
Anna
Portell
Xavier Alcobé
Xavier
Alcobé
Effect of Preorganization
on the Polymorphism and
Cocrystallization of a Squaramide Compound
American Chemical Society
2016
intramolecular hydrogen bond
laboratory
cocrystal
crystal structures
polymorph
strategy
CompoundA
supramolecular synthons
Preorganization
Polymorphism
ability
preorganization
compound
Cocrystallization
data
polymorphism
Squaramide
diffraction
resorcinol
cocrystallization
model
2016-02-20 12:46:57
Dataset
https://acs.figshare.com/articles/dataset/Effect_of_Preorganization_on_the_Polymorphism_and_Cocrystallization_of_a_Squaramide_Compound/2490565
A squaramido-based model compound with the ability to
establish
an intramolecular hydrogen bond has been designed to study the effect
of preorganization on its polymorphism and the cocrystallization with
resorcinol. Three out of the four expected supramolecular synthons
have been observed in two polymorphs and two cocrystals with resorcinol,
whose crystal structures have been solved from X-ray diffraction laboratory
data using direct-space strategies.