(2S,3R)-1-[[(4S)-Azepan-4-Yl]Carbamoyl]-3-(Sulfoamino)Pyrrolidine-2-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C12H22N4O6S |
IUPAC Name | (2s,3r)-1-[[(4s)-azepan-4-yl]carbamoyl]-3-(sulfoamino)pyrrolidine-2-carboxylic acid |
Molecular Mass | 350.391 g·mol−1 |
Heat of Formation | -1103.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.25 ± 1.08 D |
Volume | 387.07 Å 3 |
Surface Area | 337.27 Å 2 |
HOMO Energy | -8.97 ± 0.55 eV |
LUMO Energy | 2.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | WWLDRJMXWRULQB-AEJSXWLSSA-N |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |