What are the key findings of the studies that have been carried out on the compound 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde?
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The key findings of the studies on the compound 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzaldehyde are as follows: The compound's structure was confirmed using various spectroscopic techniques, including FT-IR, 1H NMR, 13C NMR, and MS, and its single crystal structure was determined by X-ray diffraction . Density functional theory (DFT) calculations were performed to calculate the molecular structure, and the results were consistent with the X-ray diffraction data . The compound's optimized structure was also determined using DFT, and it was found to be consistent with the crystal structure . Additionally, DFT calculations were used to study the compound's molecular electrostatic potential, frontier molecular orbitals, and physicochemical properties . The compound's synthesis and characterization were also investigated using various spectroscopic techniques, including FTIR, 1H NMR, 13C NMR, and MS, and its crystal structure was confirmed by X-ray diffraction .
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