6-[(2E)-2-(1,2-Dihydro-3H-Pyrazol-3-Ylidene)-2H-Benzimidazol-5-Yl]-5-Methyl-4,5-Dihydro-3(2H)-Pyridazinone

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Properties Simple | Detailed

Formula C15H14N6O
IUPAC Name (4r)-4-methyl-3-[(2z)-2-pyrazole-1,2-diium-3-ylidenebenzimidazol-5-yl]-4,5-dihydro-1h-pyridazin-6-one
Molecular Mass 294.311 g·mol−1
Heat of Formation 486.3 ± 16.7 kJ·mol−1
Dipole Moment 11.55 ± 1.08 D
Volume 336.77 Å 3
Surface Area 310.02 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy -1.96 ± eV
Point Group Symmetry C1
InChIKey IVWLPHVNIIXKML-ACKYCBKBSA-N
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