2-Oxo-6-(Sulfanylmethyl)Hexahydro-4-Pyrimidinecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C6H10N2O3S |
IUPAC Name | (4s,6s)-2-oxo-6-(sulfanylmethyl)hexahydropyrimidine-4-carboxylic acid |
Molecular Mass | 190.220 g·mol−1 |
Heat of Formation | -551.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.95 ± 1.08 D |
Volume | 211.44 Å 3 |
Surface Area | 202.38 Å 2 |
HOMO Energy | -9.30 ± 0.55 eV |
LUMO Energy | 2.32 ± eV |
Point Group Symmetry | C1 |
InChIKey | QBTQEFMFFFMOJH-IMJSIDKUSA-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 N |