Pentylone-D3

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Properties Simple | Detailed

Formula C13H17NO3
IUPAC Name (2s)-1-(1,3-benzodioxol-5-yl)-2-(methylamino)pentan-1-one
Molecular Mass 235.279 g·mol−1
Heat of Formation -370.4 ± 16.7 kJ·mol−1
Dipole Moment 3.15 ± 1.08 D
Volume 290.7 Å 3
Surface Area 268.83 Å 2
HOMO Energy -9.06 ± 0.55 eV
LUMO Energy 2.55 ± eV
Point Group Symmetry C1
InChIKey DFMLULIEUUXXSA-JTQLQIEISA-N
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