(2R,3R,4S,5R,8S,10S,15R,16R)-3,4,8,10,14,15-Hexahydroxy-7,9,11,25,26-Pentaoxa-1,17,19,22-Tetraaza-8,10-Diphosphapentacyclo[18.3.1.1~2,5~.1~13,16~.0~17,21~]Hexacosa-18,20,22-Trien-24-One 8,10-Dioxide
Properties
| Property | Value |
|---|---|
| Formula | C15H20N4O14P2 |
| IUPAC Name | (2r,3r,4s,5r,8s,10s,15r,16r)-3,4,8,10,14,15-hexahydroxy-7,9,11,25,26-pentaoxa-1,17,19,22-tetraaza-8,10-diphosphapentacyclo[18.3.1.1 2,5 .1 13,16 .0 17,21 ]hexacosa-18,20,22-trien-24-one 8,10-dioxide |
| Molecular Mass | 542.285 g·mol−1 |
| Heat of Formation | -1541.4 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.79 ± 1.08 D |
| Volume | 499.8 Å 3 |
| Surface Area | 396.01 Å 2 |
| HOMO Energy | -9.57 ± 0.55 eV |
| LUMO Energy | 0.62 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | REBZYOYBILSKBL-RYHVWOEXSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | P C O N |