11-[2-(4-Methylpiperazin-1-Yl)Acetyl]-5H-Pyrido[2,3-B][1,4]Benzodiazepin-1-Ium-4A-Id-6-One

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Formula C19H22N5O2
IUPAC Name 11-[2-(4-methylpiperazin-1-yl)acetyl]-5h-pyrido[2,3-b][1,4]benzodiazepin-1-ium-4a-id-6-one
Molecular Mass 352.410 g·mol−1
Heat of Formation 31.0 ± 16.7 kJ·mol−1
Dipole Moment 2.75 ± 1.08 D
Volume 415.38 Å 3
Surface Area 354.97 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.14 ± eV
Point Group Symmetry C1
InChIKey ZWMMALLZGGVMIN-CKXUZFMQSA-O
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