(2Xi)-2'-Deoxy-2'-Methylcytidine

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Formula C10H15N3O4
IUPAC Name 4-amino-1-[(2r,3s,4s,5r)-4-hydroxy-5-(hydroxymethyl)-3-methyl-tetrahydrofuran-2-yl]pyrimidin-3-ium-2-one
Molecular Mass 241.244 g·mol−1
Heat of Formation -660.5 ± 16.7 kJ·mol−1
Dipole Moment 5.30 ± 1.08 D
Volume 270.65 Å 3
Surface Area 242.54 Å 2
HOMO Energy -9.33 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
InChIKey DYPDKNUWDNOWPU-MTSNSDSCSA-O
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