[(3S)-3-Methylhexanoyl] 3-Methylcyclobutanecarboxylate

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Formula C13H22O3
IUPAC Name [(3s)-3-methylhexanoyl] 3-methylcyclobutanecarboxylate
Molecular Mass 226.312 g·mol−1
Heat of Formation -676.2 ± 16.7 kJ·mol−1
Dipole Moment 3.70 ± 1.08 D
Volume 307.24 Å 3
Surface Area 285.42 Å 2
HOMO Energy -10.50 ± 0.55 eV
LUMO Energy 3.62 ± eV
Point Group Symmetry C1
InChIKey LPLDFVXNOQDWSW-GARJFASQSA-N
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Elements H C O