Methyl (2S,3Ar,7Ar)-2-Carbamoyl-7-Hydroxy-2-Methyl-3A,6,7,7A-Tetrahydro-1,3-Benzodioxole-5-Carboxylate

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Formula C11H15NO6
IUPAC Name methyl (2s,3ar,7r,7ar)-2-carbamoyl-7-hydroxy-2-methyl-3a,6,7,7a-tetrahydro-1,3-benzodioxole-5-carboxylate
Molecular Mass 257.240 g·mol−1
Heat of Formation -996.0 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 286.2 Å 3
Surface Area 260.97 Å 2
HOMO Energy -10.21 ± 0.55 eV
LUMO Energy -0.60 ± eV
Point Group Symmetry C1
InChIKey SHAXHGRARCZUPJ-NKIIXMILSA-N
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