5'-Deoxy-5'-(Isonicotinoylamino)Cytidine

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Properties Simple | Detailed

Formula C15H17N5O5
IUPAC Name n-[[(2r,3s,4r,5r)-5-(4-amino-2-oxo-pyrimidin-3-ium-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl]-3h-pyridin-1-ium-3-ide-4-carboxamide
Molecular Mass 347.326 g·mol−1
Heat of Formation -649.3 ± 16.7 kJ·mol−1
Dipole Moment 5.68 ± 1.08 D
Volume 381.76 Å 3
Surface Area 328.29 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
InChIKey XQXWUTWGJVGDNS-XIDUGBJDSA-O
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