Betonicine
Properties
Property | Value |
---|---|
Formula | C7H13NO3 |
IUPAC Name | (2s,4r)-4-hydroxy-1,1-dimethyl-pyrrolidin-1-ium-2-carboxylate |
Molecular Mass | 159.183 g·mol−1 |
Heat of Formation | -480.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 9.94 ± 1.08 D |
Volume | 194.22 Å 3 |
Surface Area | 179.48 Å 2 |
HOMO Energy | -8.93 ± 0.55 eV |
LUMO Energy | 3.29 ± eV |
Point Group Symmetry | C1 |
Synonyms |
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CAS Number(s) |
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InChIKey | MUNWAHDYFVYIKH-RITPCOANSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |