1-{2-O-[2-(Aminooxy)Ethyl]-5-O-Phosphonopentofuranosyl}-5-Methyl-2,4(1H,3H)-Pyrimidinedione

Molecule SVG Image

Properties Simple | Detailed

Formula C12H20N3O10P
IUPAC Name [(2r,3r,4r,5r)-4-(2-aminooxyethoxy)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 397.275 g·mol−1
Heat of Formation -348.8 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 366.17 Å 3
Surface Area 331.04 Å 2
HOMO Energy -9.15 ± 0.55 eV
LUMO Energy -2.12 ± eV
Point Group Symmetry C1
InChIKey JDSWLJMCXJILRI-TURQNECASA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C O N