(2S,3R)-2-Amino-3-Hydroxy-3-[1-[(2R)-2-Hydroxy-1,1-Dimethyl-Propyl]Indol-1-Ium-3-Yl]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C16H22N2O4 |
IUPAC Name | (2s,3r)-2-amino-3-hydroxy-3-[1-[(2r)-2-hydroxy-1,1-dimethyl-propyl]indol-3-yl]propanoic acid |
Molecular Mass | 306.357 g·mol−1 |
Heat of Formation | -675.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.19 ± 1.08 D |
Volume | 374.08 Å 3 |
Surface Area | 310.48 Å 2 |
HOMO Energy | -8.56 ± 0.55 eV |
LUMO Energy | -0.51 ± eV |
Point Group Symmetry | C1 |
InChIKey | KBGRLEDLMUJSBM-BIGNPOOSSA-N |
QR Code | Generate QR Code |
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Elements | H C O N |