[(2R,3S,5R)-5-(3-Carbamoyl-5-Nitro-Indol-1-Ium-1-Yl)-3-Hydroxy-Tetrahydrofuran-2-Yl]Methyl Dihydrogen Phosphate
Properties
Property | Value |
---|---|
Formula | C14H16N3O9P |
IUPAC Name | [(2r,3s,5r)-5-(3-carbamoyl-5-nitro-indol-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate |
Molecular Mass | 401.265 g·mol−1 |
Heat of Formation | -1458.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 11.90 ± 1.08 D |
Volume | 410.46 Å 3 |
Surface Area | 349.8 Å 2 |
HOMO Energy | -9.33 ± 0.55 eV |
LUMO Energy | -1.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | AWLFWQPJPLUSDJ-YNEHKIRRSA-N |
QR Code | Generate QR Code |
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Elements | P C H O N |