2-Azido-N-Benzyl-7H-Purine-1,3,9-Triium-5-Id-6-Amine

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Properties Simple | Detailed

Formula C12H12N8
IUPAC Name 2-azido-n-benzyl-7h-purine-1,3,9-triium-5-id-6-amine
Molecular Mass 268.277 g·mol−1
Heat of Formation 758.7 ± 16.7 kJ·mol−1
Dipole Moment 9.37 ± 1.08 D
Volume 301.81 Å 3
Surface Area 289.74 Å 2
HOMO Energy -8.93 ± 0.55 eV
LUMO Energy 1.25 ± eV
Point Group Symmetry C1
InChIKey IKSSFECTZBBAMN-UHFFFAOYSA-N
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Elements H C N