N-[(1R,2R,6S,7S,8S,10R)-3,5-Dioxo-4-Azatetracyclo[5.3.2.0~2,6~.0~8,10~]Dodec-11-En-4-Yl]-4-(Trifluoromethyl)Benzamide

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Properties Simple | Detailed

Formula C19H15F3N2O3
IUPAC Name n-[(1r,2r,6s,7s,8s,10r)-3,5-dioxo-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-en-4-yl]-4-(trifluoromethyl)benzamide
Molecular Mass 376.329 g·mol−1
Heat of Formation -761.0 ± 16.7 kJ·mol−1
Dipole Moment 4.63 ± 1.08 D
Volume 398.45 Å 3
Surface Area 338.54 Å 2
HOMO Energy -9.98 ± 0.55 eV
LUMO Energy 1.84 ± eV
Point Group Symmetry C1
InChIKey CSKDFZIMJXRJGH-VWLPUNTISA-N
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