Raw data of the publication "Controlling optoelectronic properties and aggregation of planar dipoles through symmetry-preserving modifications"

<p>Planar and symmetric molecular architectures with defined donor–acceptor distributions offer exceptional versatility for optoelectronic applications. Perylene monoimides exemplify these features, and here we systematically explore strategies to tune their dipole-like distribution while preserving symmetry. Correlating optical properties in solution and solid state with electron-donating and/or -withdrawing groups at the ortho positions reveals how subtle modifications control the intermolecular interactions and therefore, aggregation and optoelectronics. Single-crystal X-ray diffraction further uncovers distinct stacking modes, highlighting the decisive role of molecular design in tailoring functionality for diverse applications.
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<p>The dataset contains the raw data in pdf of the High resolution Mass Spectrometry measurements, the original files provided by the UV-Vis absorption, fluorescence and electrochemistry apparatus as well as the FID from the NMR</p>