3-[2-Amino-6-(Cyclohexylmethoxy)-3H-Purin-8-Yl]-2-Methylbenzenesulfonamide

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Properties Simple | Detailed

Formula C19H24N6O3S
IUPAC Name 3-[2-amino-6-(cyclohexylmethoxy)purin-7-ium-5-ylium-8-yl]-2-methyl-benzenesulfonamide
Molecular Mass 416.497 g·mol−1
Heat of Formation -229.7 ± 16.7 kJ·mol−1
Dipole Moment 8.89 ± 1.08 D
Volume 468.97 Å 3
Surface Area 416.08 Å 2
HOMO Energy -8.71 ± 0.55 eV
LUMO Energy 2.15 ± eV
Point Group Symmetry C1
InChIKey MTASIWVJZCLGMA-UHFFFAOYSA-N
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