1-(3-Amino-2-Methylbenzyl)-4-Hexyl-2(1H)-Pyridinone

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Properties Simple | Detailed

Formula C19H26N2O+
IUPAC Name 1-[(3-amino-2-methyl-phenyl)methyl]-4-hexyl-3h-pyridin-1-ium-3-id-2-one
Molecular Mass 298.423 g·mol−1
Heat of Formation -162.2 ± 16.7 kJ·mol−1
Dipole Moment 4.85 ± 1.08 D
Volume 394.47 Å 3
Surface Area 361.38 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
InChIKey PJADLCYVDLAZCT-UHFFFAOYSA-N
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