Formula |
C5H8O4S2 |
IUPAC Name |
4-methoxy-4-oxo-3,3-bis(sulfanyl)butanoic acid |
Molecular Mass |
196.245 g·mol−1 |
Heat of Formation |
-733.6 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.86 ± 1.08 D |
Volume |
209.88 Å 3 |
Surface Area |
196.03 Å 2 |
HOMO Energy |
-9.32 ± 0.55 eV |
LUMO Energy |
-1.36 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 3,3-dimercapto-4-methoxy-4-oxobutanoic acid
- 4-keto-3,3-dimercapto-4-methoxy-butyric acid
- 4-methoxy-4-oxo-3,3-bis-sulfanyl-butanoic acid
- 4-methoxy-4-oxo-3,3-bis-sulfanylbutanoic acid
|
InChIKey |
ANGHMNAEOYYEMM-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
S
C
O
|
|
|