4-Anilino-2-[2-(1H-Imidazol-3-Ium-5-Id-5-Yl)Ethylamino]-Blahbicyclo[4.3.0]Nona-2,3,4,5,8-Pentaene-7-Carbonitrile

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Properties Simple | Detailed

Formula C17H17N9
IUPAC Name 4-anilino-2-[2-(1h-imidazol-3-ium-5-id-5-yl)ethylamino]-blahbicyclo[4.3.0]nona-2,3,4,5,8-pentaene-7-carbonitrile
Molecular Mass 347.377 g·mol−1
Heat of Formation 739.1 ± 16.7 kJ·mol−1
Dipole Moment 7.27 ± 1.08 D
Volume 398.71 Å 3
Surface Area 372.66 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.96 ± eV
Point Group Symmetry C1
InChIKey LLCCOKFREUFZIU-UHFFFAOYSA-O
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Elements H C N