4-Tert-Butyl-N-[3-[8-[4-(4-Methylpiperazine-1-Carbonyl)Anilino]-3,5-Dihydroimidazo[1,2-A]Pyrazine-1,7-Diium-3,5-Diid-6-Yl]Phenyl]Benzamide

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Formula C35H39N7O2
IUPAC Name 4-tert-butyl-n-[3-[8-[4-(4-methylpiperazine-1-carbonyl)anilino]-3,5-dihydroimidazo[1,2-a]pyrazine-1,7-diium-3,5-diid-6-yl]phenyl]benzamide
Molecular Mass 589.730 g·mol−1
Heat of Formation 148.1 ± 16.7 kJ·mol−1
Dipole Moment 3.99 ± 1.08 D
Volume 726.88 Å 3
Surface Area 533.92 Å 2
HOMO Energy -8.66 ± 0.55 eV
LUMO Energy -1.38 ± eV
Point Group Symmetry C1
InChIKey KKRFAPHBJICZFR-UHFFFAOYSA-O
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