N-(3-Methylbutyl)Adenosine 5'-(Dihydrogen Phosphate)

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Formula C15H24N5O7P
IUPAC Name [(2r,3s,4r,5r)-3,4-dihydroxy-5-[6-(isopentylamino)purin-9-yl]tetrahydrofuran-2-yl]methyl dihydrogen phosphate
Molecular Mass 417.354 g·mol−1
Heat of Formation -1410.3 ± 16.7 kJ·mol−1
Dipole Moment 5.12 ± 1.08 D
Volume 459.44 Å 3
Surface Area 390.99 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 2.42 ± eV
Point Group Symmetry C1
InChIKey GZJXCRHEMLAMRA-SDBHATRESA-N
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