1-(3-Nitrophenyl)Dihydro-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C10H9N3O4
IUPAC Name 1-(3-nitrophenyl)-1,3-diazinane-2,4-dione
Molecular Mass 235.196 g·mol−1
Heat of Formation -269.1 ± 16.7 kJ·mol−1
Dipole Moment 3.06 ± 1.08 D
Volume 249.44 Å 3
Surface Area 238.01 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 1.52 ± eV
Point Group Symmetry C1
InChIKey GMUGBPYYXAGNCT-UHFFFAOYSA-N
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