({[(1R,7R)-4-(4-Acetamidophenyl)-3,5-Dioxo-4-Azatricyclo[5.2.2.0~2,6~]Undec-1-Yl]Carbamoyl}Oxy)Acetic Acid

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Properties Simple | Detailed

Formula C21H23N3O7
IUPAC Name ({[(1r,7r)-4-(4-acetamidophenyl)-3,5-dioxo-4-azatricyclo[5.2.2.0 2,6 ]undec-1-yl]carbamoyl}oxy)acetic acid
Molecular Mass 429.423 g·mol−1
Heat of Formation -1208.2 ± 16.7 kJ·mol−1
Dipole Moment 2.30 ± 1.08 D
Volume 477.92 Å 3
Surface Area 411.95 Å 2
HOMO Energy -8.70 ± 0.55 eV
LUMO Energy 2.81 ± eV
Point Group Symmetry C1
InChIKey WBCOLMYVEBTZOA-OKRSVSQCSA-N
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