2-Butyl-5,6-Dihydro-1H-Imidazo[4,5-D]Pyridazine-4,7-Dione

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Properties Simple | Detailed

Formula C9H12N4O2++
IUPAC Name 2-butyl-5,6-dihydro-1h-imidazo[4,5-d]pyridazine-4,7-dione
Molecular Mass 208.217 g·mol−1
Heat of Formation -128.3 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 241.8 Å 3
Surface Area 238.24 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy -1.04 ± eV
Point Group Symmetry C1
Synonyms
  • 2-butyl-5,6-dihydro-1h-imidazo[4,5-d]pyridazine-4,7-quinone
  • bdi
InChIKey DQHJYYALMHIEAH-UHFFFAOYSA-N
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