3-(2-Deoxy-5-O-Phosphonopentofuranosyl)Pyrimido[1,2-A]Purin-10(3H)-One

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Properties Simple | Detailed

Formula C13H14N5O7P
IUPAC Name 3-(2-deoxy-5-o-phosphonopentofuranosyl)pyrimido[1,2-a]purin-10(3h)-one
Molecular Mass 383.253 g·mol−1
Heat of Formation 776.6 ± 16.7 kJ·mol−1
Dipole Moment 11.28 ± 1.08 D
Volume 367.11 Å 3
Surface Area 346.73 Å 2
HOMO Energy -9.47 ± 0.55 eV
LUMO Energy -1.95 ± eV
Point Group Symmetry C1
InChIKey VHESJINRMVWRRK-DJLDLDEBSA-N
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