Methyl 2-(3,6-Diamino-4-Iodo-9H-Xanthen-9-Yl)Benzoate
Properties
| Property | Value |
|---|---|
| Formula | C21H17IN2O3 |
| IUPAC Name | methyl 2-[(9s)-3,6-diamino-4-iodo-9h-xanthen-9-yl]benzoate |
| Molecular Mass | 472.276 g·mol−1 |
| Heat of Formation | -141.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.61 ± 1.08 D |
| Volume | 442.46 Å 3 |
| Surface Area | 372.42 Å 2 |
| HOMO Energy | -8.31 ± 0.55 eV |
| LUMO Energy | -0.20 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | VXSMFLODMGQAJI-SFHVURJKSA-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 |