(7R,9S)-2-Amino-7-Ethyl-9-[(2R,5S)-5-(Hydroxymethyl)-4-Oxo-Tetrahydrofuran-2-Yl]-3,8-Dihydropurin-1-Ium-6-One; Phosphenic Acid
Properties
Property | Value |
---|---|
Formula | C12H19N5O7P+ |
IUPAC Name | (7r,9s)-2-amino-7-ethyl-9-[(2r,5s)-5-(hydroxymethyl)-4-oxo-tetrahydrofuran-2-yl]-3,8-dihydropurin-1-ium-6-one; phosphenic acid |
Molecular Mass | 376.282 g·mol−1 |
Heat of Formation | -1246.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.98 ± 1.08 D |
Volume | 399.55 Å 3 |
Surface Area | 346.83 Å 2 |
HOMO Energy | -8.16 ± 0.55 eV |
LUMO Energy | -0.77 ± eV |
Point Group Symmetry | C1 |
InChIKey | DAUIPRHSYNKLFO-QRPMWFLTSA-O |
QR Code | Generate QR Code |
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Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | P C H O N |