6-(3-Amino-2H-Indazol-6-Yl)-N~4~-Ethyl-2,4-Pyrimidinediamine

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Properties Simple | Detailed

Formula C13H15N7
IUPAC Name 6-(3-amino-4h-indazol-2-ium-4-id-6-yl)-n4-ethyl-pyrimidine-2,4-diamine
Molecular Mass 269.305 g·mol−1
Heat of Formation 403.8 ± 16.7 kJ·mol−1
Dipole Moment 4.57 ± 1.08 D
Volume 313.23 Å 3
Surface Area 300.34 Å 2
HOMO Energy -8.62 ± 0.55 eV
LUMO Energy 2.44 ± eV
Point Group Symmetry C1
InChIKey RIXHCYHQTKRWDU-UHFFFAOYSA-N
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Elements H C N