3-[(2R)-2-[(Benzylsulfonyl)Amino]-2-(Dihydroxyboryl)Ethyl]Benzoic Acid
Properties
Property | Value |
---|---|
Formula | C16H18BNO6S |
IUPAC Name | 3-[2-(benzylsulfonylamino)-2-borono-ethyl]benzoic acid |
Molecular Mass | 363.193 g·mol−1 |
Heat of Formation | -1169.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.26 ± 1.08 D |
Volume | 416.37 Å 3 |
Surface Area | 359.6 Å 2 |
HOMO Energy | -9.71 ± 0.55 eV |
LUMO Energy | -0.90 ± eV |
Point Group Symmetry | C1 |
InChIKey | LCKOZWBVAVBOPR-HNNXBMFYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | C B H O N S |