We describe the self-assembly of soluble, chemically modified fullerene [6,6]-phenyl C 61 butyric acid methyl ester (PCBM) into a new crystalline phase where the C 60 moieties are arranged in parallel layers. Minimum C 60 center-to-center distance is 10 within the layers, and up to 15 perpendicular to the layers. Highly anisotropic, mesoscopic hexagonal crystals of this material, with a lateral size of many microns and a thickness below 1 ?m, are obtained from chloroform solution by solvent vapor annealing, and characterized by optical microscopy and X-ray diffraction. The crystalline structure is deduced combining experimental data with molecular modeling and ab initio calculations. The large difference in C 60-C 60 spacing indicates a high anisotropy in electrical and charge transport properties of this new phase. © 2011 Elsevier Ltd. All rights reserved.

Anisotropic molecular packing of soluble C 60 fullerenes in hexagonal nanocrystals obtained by solvent vapor annealing

Grosso;Gazzano;Palermo;
2012

Abstract

We describe the self-assembly of soluble, chemically modified fullerene [6,6]-phenyl C 61 butyric acid methyl ester (PCBM) into a new crystalline phase where the C 60 moieties are arranged in parallel layers. Minimum C 60 center-to-center distance is 10 within the layers, and up to 15 perpendicular to the layers. Highly anisotropic, mesoscopic hexagonal crystals of this material, with a lateral size of many microns and a thickness below 1 ?m, are obtained from chloroform solution by solvent vapor annealing, and characterized by optical microscopy and X-ray diffraction. The crystalline structure is deduced combining experimental data with molecular modeling and ab initio calculations. The large difference in C 60-C 60 spacing indicates a high anisotropy in electrical and charge transport properties of this new phase. © 2011 Elsevier Ltd. All rights reserved.
2012
Istituto per la Sintesi Organica e la Fotoreattivita' - ISOF
Istituto Nanoscienze - NANO
Ab initio calculations
Chemically modified
Chloroform solutions
Crystalline phase
Crystalline structure
Experimental data
Hexagonal crystals
Hexagonal nanocrystals
High anisotropy
Lateral sizes
Mesoscopics
Methyl esters
Molecular packings
Soluble C
Solvent vapors
Butyric acid
Calculations
Crystalline materials
Electric properties
Fatty acids
Fullerenes
Optical microscopy
Organic solvents
Transport properties
Vapors
X ray diffraction
Anisotropy
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/20.500.14243/250716
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