4-(4-Amino-1-Piperidyl)-2-[(2-Aminopyrimidine-1,3-Diium-5-Id-5-Yl)Methylamino]-5-Nitro-Benzamide
Properties
| Property | Value |
|---|---|
| Formula | C17H22N8O3 |
| IUPAC Name | 4-(4-amino-1-piperidyl)-2-[(2-aminopyrimidine-1,3-diium-5-id-5-yl)methylamino]-5-nitro-benzamide |
| Molecular Mass | 386.408 g·mol−1 |
| Heat of Formation | 28.0 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.05 ± 1.08 D |
| Volume | 439.25 Å 3 |
| Surface Area | 387.37 Å 2 |
| HOMO Energy | -8.94 ± 0.55 eV |
| LUMO Energy | 2.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | OVZJNRDNLVBDHO-UHFFFAOYSA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |