(2E,6E)-3,7-Dimethyl-8-({5-[(3As,4S,6Ar)-2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl]Pentanoyl}Amino)-2,6-Octadien-1-Yl Trihydrogen Diphosphate
Properties
Property | Value |
---|---|
Formula | C20H35N3O9P2S |
IUPAC Name | [(2e,6e)-8-[5-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]-3,7-dimethyl-octa-2,6-dienyl] phosphono hydrogen phosphate |
Molecular Mass | 555.519 g·mol−1 |
Heat of Formation | -2285.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.34 ± 1.08 D |
Volume | 633.61 Å 3 |
Surface Area | 562.72 Å 2 |
HOMO Energy | -9.00 ± 0.55 eV |
LUMO Energy | -1.35 ± eV |
Point Group Symmetry | C1 |
InChIKey | XZJFCDBLIMGOSX-VRLLXNLQSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C H O N P S |