5-[4-[Benzyl(Methyl)Amino]-3-Nitro-Phenyl]-6-Ethyl-Pyrimidine-1,3-Diium-5-Ide-2,4-Diamine
Properties
| Property | Value |
|---|---|
| Formula | C20H22N6O2 |
| IUPAC Name | 5-[4-[benzyl(methyl)amino]-3-nitro-phenyl]-6-ethyl-pyrimidine-1,3-diium-5-ide-2,4-diamine |
| Molecular Mass | 378.428 g·mol−1 |
| Heat of Formation | 240.3 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.26 ± 1.08 D |
| Volume | 452.01 Å 3 |
| Surface Area | 352.22 Å 2 |
| HOMO Energy | -8.94 ± 0.55 eV |
| LUMO Energy | -1.31 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | UCGMZLDPVBHQHF-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
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| Elements | H C O N |