3-[(1R,2S,3S,5Z,7S,8S,9Z,11S,12S,13S,14Z,19S)-7,12,18-Tris(2-Carboxyethyl)-3,8,13,17-Tetrakis(Carboxymethyl)-8,13-Dimethyl-1,2,3,7,11,12,19,20,22,23-Decahydroporphyrin-2-Yl]Propanoic Acid
Properties
| Property | Value |
|---|---|
| Formula | C42H52N4O16 |
| IUPAC Name | 3-[(1r,2s,3s,5z,7s,8s,9z,11s,12s,13s,14z,19s)-7,12,18-tris(2-carboxyethyl)-3,8,13,17-tetrakis(carboxymethyl)-8,13-dimethyl-1,2,3,7,11,12,19,20,22,23-decahydroporphyrin-2-yl]propanoic acid |
| Molecular Mass | 868.879 g·mol−1 |
| Heat of Formation | -3035.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 1.70 ± 1.08 D |
| Volume | 1025.13 Å 3 |
| Surface Area | 694.9 Å 2 |
| HOMO Energy | -8.33 ± 0.55 eV |
| LUMO Energy | 2.66 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | PTDGOSZHGZMQAZ-IIRIWOCESA-N |
| QR Code | Generate QR Code |
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| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O N |