2-Ethyl-5,7-Dimethyl-3-{(1S)-5-[2-(1H-Tetrazol-5-Yl)Phenyl]-2,3-Dihydro-1H-Inden-1-Yl}-3H-Imidazo[4,5-B]Pyridine

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Properties Simple | Detailed

Formula C26H25N7
IUPAC Name 3-[(1s)-5-[2-(2,3-diaza-1-azonia-4-azanidacyclopenta-2,5-dien-5-yl)phenyl]indan-1-yl]-2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ium
Molecular Mass 435.524 g·mol−1
Heat of Formation 587.9 ± 16.7 kJ·mol−1
Dipole Moment 7.81 ± 1.08 D
Volume 519.88 Å 3
Surface Area 411.84 Å 2
HOMO Energy -8.87 ± 0.55 eV
LUMO Energy 1.10 ± eV
Point Group Symmetry C1
InChIKey PACFDFGGIPMOKL-QFIPXVFZSA-N
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Elements H C N