(1S,2R,7R,9S)-6-Acetyl-12-Methyl-4-Oxa-12-Azatricyclo[7.2.1.0~2,7~]Dodec-5-En-10-One

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Formula C13H17NO3
IUPAC Name (1s,2r,7r,9s)-6-acetyl-12-methyl-4-oxa-12-azatricyclo[7.2.1.02,7]dodec-5-en-10-one
Molecular Mass 235.279 g·mol−1
Heat of Formation -434.3 ± 16.7 kJ·mol−1
Dipole Moment 4.87 ± 1.08 D
Volume 282.61 Å 3
Surface Area 244.63 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy 3.02 ± eV
Point Group Symmetry C1
InChIKey JXSYWKVPVCKAFM-IELRGYKMSA-N
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