6-(3-Aminobenzyl)-4-Methyl-2-(Methylsulfinyl)-4,6-Dihydro-5H-Thieno[2',3':4,5]Pyrrolo[2,3-D]Pyridazin-5-One

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Formula C17H24N4O2S2+
IUPAC Name 6-[(3-aminophenyl)methyl]-4-methyl-2-[(r)-methylsulfinyl]thieno[1,2]pyrrolo[3,4-d]pyridazine-4,6-diium-5-one
Molecular Mass 380.528 g·mol−1
Heat of Formation 152.7 ± 16.7 kJ·mol−1
Dipole Moment 6.65 ± 1.08 D
Volume 411.35 Å 3
Surface Area 362.94 Å 2
HOMO Energy -8.27 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
InChIKey ZWKJWVSEDISQIS-RUZDIDTESA-N
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