6-(Dimethylamino)-3-Phenyl-1,2,3,5-Tetrazin-4-One

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Properties Simple | Detailed

Formula C10H11N5O
IUPAC Name 6-(dimethylamino)-3-phenyl-1,2,3,5-tetrazin-4-one
Molecular Mass 217.227 g·mol−1
Heat of Formation 247.9 ± 16.7 kJ·mol−1
Dipole Moment 4.05 ± 1.08 D
Volume 245.99 Å 3
Surface Area 239.74 Å 2
HOMO Energy -9.19 ± 0.55 eV
LUMO Energy -1.47 ± eV
Point Group Symmetry C1
InChIKey KFZHQQAQJYECBZ-UHFFFAOYSA-N
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