(2E)-N-[(3S,7S,10S)-3-Isobutyl-7-Methyl-2,5,6,9-Tetraoxo-1,4,8-Triazacyclotridecan-10-Yl]-6-Methyl-2-Octenamide
Properties
Property | Value |
---|---|
Formula | C24H40N4O5 |
IUPAC Name | (e,6r)-n-[(3s,7s,10s)-3-isobutyl-7-methyl-2,5,6,9-tetraoxo-1,4,8-triazacyclotridec-10-yl]-6-methyl-oct-2-enamide |
Molecular Mass | 464.598 g·mol−1 |
Heat of Formation | -1073.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 0.68 ± 1.08 D |
Volume | 603.18 Å 3 |
Surface Area | 490.29 Å 2 |
HOMO Energy | -9.62 ± 0.55 eV |
LUMO Energy | -0.27 ± eV |
Point Group Symmetry | C1 |
InChIKey | YNIGBMUXBCZRNQ-CGWFXPDQSA-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 |