2-Amino-7-[(2S,3S,4S,5S)-3,4-Dihydroxy-5-(Hydroxymethyl)-2-Pyrrolidinyl]-3,5-Dihydro-4H-Pyrrolo[3,2-D]Pyrimidin-4-One

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Formula C11H22N5O4+
IUPAC Name 2-amino-7-[(2s,3s,4s,5s)-3,4-dihydroxy-5-(hydroxymethyl)pyrrolidin-2-yl]-5,6-dihydro-1h-pyrrolo[3,2-d]pyrimidine-2,3,4a,6,7,7a-hexaid-4-one
Molecular Mass 288.323 g·mol−1
Heat of Formation -509.0 ± 16.7 kJ·mol−1
Dipole Moment 5.60 ± 1.08 D
Volume 309.91 Å 3
Surface Area 277.74 Å 2
HOMO Energy -9.07 ± 0.55 eV
LUMO Energy -0.23 ± eV
Point Group Symmetry C1
InChIKey KBIDJCVAURJXFG-VQVVZVRGSA-N
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