D-6-(2-(3-Amidinoureido)-2-Phenylacetamido)-3,3-Dimethyl-7-Oxo-4-Thia-1-Azabicyclo(3.2.0)Heptane-2-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C18H22N6O5S |
IUPAC Name | (2r,5r,6r)-6-[[(2r)-2-(diaminomethylenecarbamoylamino)-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid |
Molecular Mass | 434.469 g·mol−1 |
Heat of Formation | -634.8 ± 16.7 kJ·mol−1 |
Dipole Moment | 2.13 ± 1.08 D |
Volume | 490.75 Å 3 |
Surface Area | 393.02 Å 2 |
HOMO Energy | -9.12 ± 0.55 eV |
LUMO Energy | -0.56 ± eV |
Point Group Symmetry | C1 |
InChIKey | GIPLLNWRTXVAHM-ZHSDAYTOSA-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 |