1,1'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(methylene)]bis(N-nitro-1H-1,2,4-triazol-4-ium-4-aminide)
Chemical Structure Depiction of
1,1'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(methylene)]bis(N-nitro-1H-1,2,4-triazol-4-ium-4-aminide)
1,1'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(methylene)]bis(N-nitro-1H-1,2,4-triazol-4-ium-4-aminide)
Compound characteristics
| Compound ID: | 8012-8840 |
| Compound Name: | 1,1'-[(4-amino-4H-1,2,4-triazole-3,5-diyl)bis(methylene)]bis(N-nitro-1H-1,2,4-triazol-4-ium-4-aminide) |
| Molecular Weight: | 366.26 |
| Molecular Formula: | C8 H10 N14 O4 |
| Smiles: | C(c1nnc(Cn2c[n+](cn2)[N-][N+]([O-])=O)n1N)n1c[n+](cn1)[N-][N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -4.4911 |
| logD: | -4.4911 |
| logSw: | -0.5174 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 176.687 |
| InChI Key: | XXTQRIDKYIAJTD-UHFFFAOYSA-N |