N-{3-[2-Methoxy-3-(2-Methyl-2-Propanyl)-5-(2-Oxo-1,2-Dihydro-3-Pyridinyl)Phenyl]-1-Oxo-1H-Isochromen-7-Yl}Methanesulfonamide

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Properties Simple | Detailed

Formula C26H27N2O6S++
IUPAC Name n-[3-[3-tert-butyl-2-methoxy-5-(2-oxo-3-pyridyl)phenyl]-1-oxo-isochromen-7-yl]methanesulfonamide
Molecular Mass 495.567 g·mol−1
Heat of Formation -755.1 ± 16.7 kJ·mol−1
Dipole Moment 5.55 ± 1.08 D
Volume 559.18 Å 3
Surface Area 474.01 Å 2
HOMO Energy -8.50 ± 0.55 eV
LUMO Energy -1.01 ± eV
Point Group Symmetry C1
InChIKey KFKYTAVFBQWLAZ-UHFFFAOYSA-N
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