4-{3-[4-(4-Methyl-1-Piperazinyl)-1H-Benzimidazol-2-Yl]-1H-Indazol-6-Yl}Aniline

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Properties Simple | Detailed

Formula C25H25N7
IUPAC Name 4-[3-[4-(4-methylpiperazin-1-yl)benzimidazol-3-ium-2-yl]indazol-1-ium-3a-id-6-yl]aniline
Molecular Mass 423.513 g·mol−1
Heat of Formation 616.6 ± 16.7 kJ·mol−1
Dipole Moment 4.12 ± 1.08 D
Volume 504.74 Å 3
Surface Area 445.22 Å 2
HOMO Energy -8.39 ± 0.55 eV
LUMO Energy 1.26 ± eV
Point Group Symmetry C1
InChIKey LPSCCOBGZSKECZ-UHFFFAOYSA-N
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Elements H C N