4-Nitropyrene

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Formula C16H9NO2
IUPAC Name 4-nitropyrene
Molecular Mass 247.248 g·mol−1
Heat of Formation 254.6 ± 16.7 kJ·mol−1
Dipole Moment 5.44 ± 1.08 D
Volume 271.16 Å 3
Surface Area 246.79 Å 2
HOMO Energy -8.85 ± 0.55 eV
LUMO Energy 2.18 ± eV
Point Group Symmetry Cs
InChIKey ZEQMKNCDJFKQMQ-UHFFFAOYSA-N
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