4-Methyl-1H-Pyrimido[4,5-B][1,5]Benzodiazepine-2,5-Dione

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Formula C12H8N4O2
IUPAC Name 4-methyl-1h-pyrimido[4,5-b][1,5]benzodiazepine-2,5-dione
Molecular Mass 240.218 g·mol−1
Heat of Formation 131.9 ± 16.7 kJ·mol−1
Dipole Moment 3.83 ± 1.08 D
Volume 258.15 Å 3
Surface Area 242.37 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 0.80 ± eV
Point Group Symmetry C1
InChIKey ILYOWFONKJBUCA-UHFFFAOYSA-O
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