2-[(2R)-2-Butanyl]-4,6-Dinitrophenyl 3-Methyl-2-Butenoate

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Properties Simple | Detailed

Formula C15H18N2O6
IUPAC Name [2-[(1r)-1-methylpropyl]-4,6-dinitro-phenyl] 3-methylbut-2-enoate
Molecular Mass 322.313 g·mol−1
Heat of Formation -383.1 ± 16.7 kJ·mol−1
Dipole Moment 7.96 ± 1.08 D
Volume 375.04 Å 3
Surface Area 328.85 Å 2
HOMO Energy -10.43 ± 0.55 eV
LUMO Energy 1.30 ± eV
Point Group Symmetry C1
InChIKey ZRDUSMYWDRPZRM-SNVBAGLBSA-N
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