(2S,3S,4R,6R)-4-(Dimethylamino)-3-Methoxy-2-Methyl-29-Oxa-1,7,17-Triazaoctacyclo[12.12.2.1~2,6~.0~7,28~.0~8,13~.0~15,19~.0~20,27~.0~21,26~]Nonacosa-8,10,12,14,19,21,23,25,27-Nonaen-16-One
Properties
| Property | Value |
|---|---|
| Formula | C29H28N4O3 |
| IUPAC Name | (2s,3r,4r,6r)-4-(dimethylamino)-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.1 2,6 .0 7,28 .0 8,13 .0 15,19 .0 20,27 .0 21,26 ]nonacosa-8,10,12,14,19,21,23,25,27-nonaen-16-one |
| Molecular Mass | 480.558 g·mol−1 |
| Heat of Formation | -81.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 9.09 ± 1.08 D |
| Volume | 549.45 Å 3 |
| Surface Area | 408.37 Å 2 |
| HOMO Energy | -7.66 ± 0.55 eV |
| LUMO Energy | 3.45 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | NJFTXXMZGIINOF-QVZIYMECSA-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 |