(3S)-3-Methylhex-1-En-1-One

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Properties Simple | Detailed

Formula C7H12O
IUPAC Name (3s)-3-methylhex-1-en-1-one
Molecular Mass 112.170 g·mol−1
Heat of Formation -186.7 ± 16.7 kJ·mol−1
Dipole Moment 1.20 ± 1.08 D
Volume 164.87 Å 3
Surface Area 170.16 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy -0.06 ± eV
Point Group Symmetry C1
InChIKey JSEVQPZPZGRAFU-ZETCQYMHSA-N
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Elements H C O