[3-({3-[1,2-Bis(2-Oxiranylmethyl)-3,5-Dioxo-1,2,4-Triazolidin-4-Yl]-2-Hydroxypropyl}Amino)-1-Hydroxy-1,1-Propanediyl]Bis(Phosphonic Acid)
Properties
| Property | Value |
|---|---|
| Formula | C14H26N4O12P2 |
| IUPAC Name | [3-({3-[1,2-bis(2-oxiranylmethyl)-3,5-dioxo-1,2,4-triazolidin-4-yl]-2-hydroxypropyl}amino)-1-hydroxy-1,1-propanediyl]bis(phosphonic acid) |
| Molecular Mass | 504.323 g·mol−1 |
| Heat of Formation | -521.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.30 ± 1.08 D |
| Volume | 454.83 Å 3 |
| Surface Area | 417.41 Å 2 |
| HOMO Energy | -9.18 ± 0.55 eV |
| LUMO Energy | -1.90 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | QAAVTVFAFOUUEE-DCAQKATOSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C O N |