1,9-Dimethyl-3H-Pyrazolo[1,2-A][1,2,3,4]Benzotetrazin-3-One

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Properties Simple | Detailed

Formula C11H21N4O+
IUPAC Name 1,9-dimethylpyrazolo[1,2-a][1,2,3,4]benzotetrazin-3-one
Molecular Mass 225.311 g·mol−1
Heat of Formation 312.9 ± 16.7 kJ·mol−1
Dipole Moment 9.11 ± 1.08 D
Volume 239.33 Å 3
Surface Area 229.46 Å 2
HOMO Energy -8.48 ± 0.55 eV
LUMO Energy 1.94 ± eV
Point Group Symmetry C1
Synonyms
  • 1,9-dimethyl-3-pyrazolo[1,2-a][1,2,3,4]benzotetrazinone
InChIKey YZXLJNWLBZWUHP-UHFFFAOYSA-N
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