N-{[(2S)-1-Ethyl-2-Pyrrolidinyl]Methyl}-2-Hydroxy-3-(~123~I)Iodo-6-Methoxybenzamide
Properties
| Property | Value |
|---|---|
| Formula | C15H21IN2O3 |
| IUPAC Name | n-[[(1r,2s)-1-ethylpyrrolidin-2-yl]methyl]-2-hydroxy-3-(123i)iodanyl-6-methoxy-benzamide |
| Molecular Mass | 400.244 g·mol−1 |
| Heat of Formation | -418.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.11 ± 1.08 D |
| Volume | 384.04 Å 3 |
| Surface Area | 340.15 Å 2 |
| HOMO Energy | -8.41 ± 0.55 eV |
| LUMO Energy | 2.33 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | CANPFCFJURGKAX-SCBSARHOSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | I H C O N |