Methyl (2S,3Ar,7Ar)-2-Carbamoyl-7-Hydroxy-2-Methyl-3A,6,7,7A-Tetrahydro-1,3-Benzodioxole-5-Carboxylate
Properties
Property | Value |
---|---|
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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |