3-[(E)-2-(5-Nitro-2-Furyl)Vinyl]-1-Oxa-4-Azonia-2-Azanidacyclopenta-3,4-Dien-5-Amine

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Properties Simple | Detailed

Formula C8H7N4O4+
IUPAC Name 3-[(e)-2-(5-nitro-2-furyl)vinyl]-1-oxa-4-azonia-2-azanidacyclopenta-3,4-dien-5-amine
Molecular Mass 223.166 g·mol−1
Heat of Formation 163.0 ± 16.7 kJ·mol−1
Dipole Moment 6.46 ± 1.08 D
Volume 233.07 Å 3
Surface Area 235.55 Å 2
HOMO Energy -9.71 ± 0.55 eV
LUMO Energy 1.21 ± eV
Point Group Symmetry C1
InChIKey PVMXGJKFILHWDB-HNQUOIGGSA-N
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