5-(2-Propoxyphenyl)Triazolo[4,5-D]Pyrimidine-2,3,4,6-Tetraium-7-One

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Formula C13H15N5O2
IUPAC Name 5-(2-propoxyphenyl)triazolo[4,5-d]pyrimidine-2,3,4,6-tetraium-7-one
Molecular Mass 273.291 g·mol−1
Heat of Formation 238.2 ± 16.7 kJ·mol−1
Dipole Moment 4.56 ± 1.08 D
Volume 311.23 Å 3
Surface Area 289.83 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy 1.18 ± eV
Point Group Symmetry C1
InChIKey AZBWBPUQTPMCDI-UHFFFAOYSA-O
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