Experimental Charge Density Analysis and Electrostatic Properties of Crystalline 1,3-Bis(Dimethylamino)Squaraine and Its Dihydrate from Low Temperature (T = 18 and 20 K) XRD Data

Experimental Charge Density Analysis and Electrostatic Properties of Crystalline 1,3-Bis(Dimethylamino)Squaraine and Its Dihydrate from Low Temperature (T = 18 and 20 K) XRD Data

Multipolar refinements of structural models fitting extensive sets of X-ray diffraction (XRD) data from single crystals of 1,3-bis(dimethylamino)squaraine [SQ, C<sub>8</sub>H<sub>12</sub>N<sub>2</sub>O<sub>2</sub>] and its dihydrate [SQDH, C<sub>...

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Bibliographic Details
Main Authors: Riccardo Destro, Pietro Roversi, Raffaella Soave, Arjan Hovestad, Leonardo Lo Presti
Format: Article
Language:English
Published: MDPI AG 2020-10-01
Series:Crystals
Subjects:
single crystal
X-ray diffraction
charge density
squaraine
low temperature
Quantum Theory of Atoms in Molecules
Online Access:https://www.mdpi.com/2073-4352/10/10/894

Internet

https://www.mdpi.com/2073-4352/10/10/894

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