(4As,5Ar,6R,8As,8Bs)-5A-(Carboxymethyl)-8-Oxo-2,4A,5A,6,7,8,8A,8B-Octahydro-1H-Pyrrolo[3',4':4,5]Furo[3,2-B]Pyridine-6-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C12H14N2O6 |
IUPAC Name | (4as,5ar,6r,8as,8bs)-5a-(carboxymethyl)-8-oxo-2,4a,6,7,8a,8b-hexahydro-1h-pyrrolo[3,4]furo[1,3-b]pyridine-6-carboxylic acid |
Molecular Mass | 282.249 g·mol−1 |
Heat of Formation | -982.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.61 ± 1.08 D |
Volume | 299.23 Å 3 |
Surface Area | 255.46 Å 2 |
HOMO Energy | -9.64 ± 0.55 eV |
LUMO Energy | 3.38 ± eV |
Point Group Symmetry | C1 |
InChIKey | RVLCVCHOUKAPIG-WCPLEAOBSA-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 |