5-Amino-N-Cyclopropyl-3-(4-Fluorophenyl)-4-Oxo-3,4-Dihydrothieno[3,4-D]Pyridazine-1-Carboxamide

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Formula C16H13FN4O2S
IUPAC Name 5-amino-n-cyclopropyl-3-(4-fluorophenyl)-4-oxo-thieno[3,4-d]pyridazine-3,6-diium-1-carboxamide
Molecular Mass 344.363 g·mol−1
Heat of Formation -73.6 ± 16.7 kJ·mol−1
Dipole Moment 6.49 ± 1.08 D
Volume 374.5 Å 3
Surface Area 338.81 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy 1.87 ± eV
Point Group Symmetry C1
InChIKey YLDONMOUAPUZEL-UHFFFAOYSA-O
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