1-{[1-(4-Amino-1,3,5-Triazin-2-Yl)-2-Methyl-1H-Benzimidazol-6-Yl]Ethynyl}Cyclohexanol

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Formula C19H20N6O
IUPAC Name 1-[2-[3-(4-amino-1,3,5-triazin-2-yl)-2-methyl-benzimidazol-3-ium-5-yl]ethynyl]cyclohexanol
Molecular Mass 348.402 g·mol−1
Heat of Formation 337.4 ± 16.7 kJ·mol−1
Dipole Moment 4.88 ± 1.08 D
Volume 413.96 Å 3
Surface Area 370.58 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 1.88 ± eV
Point Group Symmetry C1
InChIKey RSIUBEYNBJJYTG-UHFFFAOYSA-N
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