3,3-Dimethylhexanoyl (1S,2S)-2-Methylcyclopropanecarboxylate

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Formula C13H22O3
IUPAC Name 3,3-dimethylhexanoyl (1s,2s)-2-methylcyclopropanecarboxylate
Molecular Mass 226.312 g·mol−1
Heat of Formation -635.6 ± 16.7 kJ·mol−1
Dipole Moment 4.05 ± 1.08 D
Volume 304.4 Å 3
Surface Area 285.9 Å 2
HOMO Energy -10.45 ± 0.55 eV
LUMO Energy 3.56 ± eV
Point Group Symmetry C1
InChIKey FNRLHBHHRCLYCX-UWVGGRQHSA-N
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Elements H C O