4-[(3As,4S,6Ar)-2-Oxohexahydro-1H-Thieno[3,4-D]Imidazol-4-Yl]Butanoic Acid
Properties
Property | Value |
---|---|
Formula | C9H14N2O3S |
IUPAC Name | 4-[(3as,4s,6ar)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]butanoic acid |
Molecular Mass | 230.284 g·mol−1 |
Heat of Formation | -579.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.53 ± 1.08 D |
Volume | 263.54 Å 3 |
Surface Area | 245.37 Å 2 |
HOMO Energy | -9.03 ± 0.55 eV |
LUMO Energy | -0.51 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
InChIKey | AINAXQHKYSZESH-HAFWLYHUSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S O N |