1-({[5-(4-Amino-2-Oxo-1(2H)-Pyrimidinyl)-2,5-Dihydro-2-Furanyl]Methyl}Amino)-4-(Methylsulfanyl)-1-Oxo-2-Butanaminium

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Properties Simple | Detailed

Formula C14H21N5O3S+
IUPAC Name (2s)-2-amino-n-[[(2r,5r)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2,5-dihydrofuran-2-yl]methyl]-4-methylsulfanyl-butanamide
Molecular Mass 339.413 g·mol−1
Heat of Formation -358.4 ± 16.7 kJ·mol−1
Dipole Moment 4.47 ± 1.08 D
Volume 409.3 Å 3
Surface Area 341.52 Å 2
HOMO Energy -8.42 ± 0.55 eV
LUMO Energy -0.45 ± eV
Point Group Symmetry C1
InChIKey FPJUBBSKQUNWLH-JFGNBEQYSA-N
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