3-[(4Z,9Z)-8,13,17-Tris(2-Carboxyethyl)-2,7,18-Tris(Carboxymethyl)-1,2,7,12,12,15,17-Heptamethyl-3,8,15,18,19,21-Hexahydrocorrin-3-Yl]Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C44H58N4O14 |
| IUPAC Name | 3-[(1r,2s,3s,4z,7s,8s,9z,15r,17r,18r,19r)-8,13,17-tris(2-carboxyethyl)-2,7,18-tris(carboxymethyl)-1,2,7,12,12,15,17-heptamethyl-3,8,15,18,19,21-hexahydrocorrin-3-yl]propanoic acid |
| Molecular Mass | 866.950 g·mol−1 |
| Heat of Formation | -2658.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 5.08 ± 1.08 D |
| Volume | 1030.17 Å 3 |
| Surface Area | 702.61 Å 2 |
| HOMO Energy | -8.01 ± 0.55 eV |
| LUMO Energy | -0.66 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | LIJKCTVSMYEQAC-IBWMGOEXSA-N |
| QR Code | Generate QR Code |
| Links | ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |