3-(4-Methoxyanilino)-2,5,7,8-Tetraza-1-Azonia-9-Azanidabicyclo[4.3.0]Nona-1(6),2,7-Trien-4-One

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Formula C10H9N7O2
IUPAC Name 6-(4-methoxyanilino)tetrazolo[1,5-b][1,2,4]triazine-4,8-diium-7-one
Molecular Mass 259.224 g·mol−1
Heat of Formation 362.8 ± 16.7 kJ·mol−1
Dipole Moment 6.04 ± 1.08 D
Volume 279.51 Å 3
Surface Area 264.52 Å 2
HOMO Energy -8.79 ± 0.55 eV
LUMO Energy -1.93 ± eV
Point Group Symmetry Cs
InChIKey XKUOUXMLNDLJEA-UHFFFAOYSA-P
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