N-Deacetylshermilamine B

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Formula C19H16N4OS
IUPAC Name n-deacetylshermilamine b
Molecular Mass 348.422 g·mol−1
Heat of Formation 132.9 ± 16.7 kJ·mol−1
Dipole Moment 7.20 ± 1.08 D
Volume 383.15 Å 3
Surface Area 333.97 Å 2
HOMO Energy -7.83 ± 0.55 eV
LUMO Energy -1.19 ± eV
Point Group Symmetry C1
InChIKey LHOMOJRZMZIBEM-UHFFFAOYSA-N
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