3-[(2S,3R,4R)-5-(7,8-Dimethyl-2,4-Dioxo-Benzo[G]Pteridine-1,5-Diium-9A-Id-10-Yl)-2,3,4-Trihydroxy-Pentoxy]-3-Oxo-Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C20H24N4O9++ |
IUPAC Name | 3-[(2s,3r,4r)-5-(7,8-dimethyl-2,4-dioxo-benzo[g]pteridine-1,5-diium-9a-id-10-yl)-2,3,4-trihydroxy-pentoxy]-3-oxo-propanoic acid |
Molecular Mass | 464.426 g·mol−1 |
Heat of Formation | -1454.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.88 ± 1.08 D |
Volume | 499.38 Å 3 |
Surface Area | 425.51 Å 2 |
HOMO Energy | -9.29 ± 0.55 eV |
LUMO Energy | 1.08 ± eV |
Point Group Symmetry | C1 |
InChIKey | XKQKRXFRFIPTGL-IIYDPXPESA-P |
QR Code | Generate QR Code |
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Elements | H C O N |