(2S,5S,8S,13S,Z)-2-Cinnamyl-5-(Cyclohexylmethyl)-3,6,9,15,18-Pentaoxo-8-(3-(Pyrazine-2-Carboxamido)Propyl)-1,4,7,10,14-Pentaazacyclooctadec-16-Ene-13-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C38H49N9O7 |
| IUPAC Name | (2s,5s,8s,13s,16z)-2-[(e)-cinnamyl]-5-(cyclohexylmethyl)-3,6,9,15,18-pentaoxo-8-[3-(pyrazine-2-carbonylamino)propyl]-1,4,7,10,14-pentazacyclooctadec-16-ene-13-carboxamide |
| Molecular Mass | 743.852 g·mol−1 |
| Heat of Formation | -1061.6 ± 16.7 kJ·mol−1 |
| Dipole Moment | 7.63 ± 1.08 D |
| Volume | 898.75 Å 3 |
| Surface Area | 681.38 Å 2 |
| HOMO Energy | -9.34 ± 0.55 eV |
| LUMO Energy | -1.21 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | WWKVFSPICQNZHM-ILFUNVDESA-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 |