[2-[(1R)-1-Methylpropyl]-4,6-Dinitro-Phenyl] Acetate

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Properties Simple | Detailed

Formula C12H14N2O6
IUPAC Name [2-[(1r)-1-methylpropyl]-4,6-dinitro-phenyl] acetate
Molecular Mass 282.249 g·mol−1
Heat of Formation -398.4 ± 16.7 kJ·mol−1
Dipole Moment 6.68 ± 1.08 D
Volume 318.09 Å 3
Surface Area 280.11 Å 2
HOMO Energy -10.61 ± 0.55 eV
LUMO Energy 1.10 ± eV
Point Group Symmetry C1
InChIKey OKRKKAFXDIRMQW-SSDOTTSWSA-N
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