1-{[1-(4-Amino-1,3,5-Triazin-2-Yl)-2-Methyl-1H-Benzimidazol-6-Yl]Ethynyl}Cyclohexanol
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
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Elements | H C O N |