(3S,6S,9R,12S,16R)-6-[(2S)-2-Butanyl]-3,12-Diisopropyl-9-Methyl-16-[(E)-2-Phenylvinyl]-1-Oxa-4,7,10,13-Tetraazacyclohexadecane-2,5,8,11,14-Pentone
Properties
Property | Value |
---|---|
Formula | C30H44N4O6 |
IUPAC Name | (3s,6s,9r,12s,16r)-3,12-diisopropyl-9-methyl-6-[(1s)-1-methylpropyl]-16-[(e)-styryl]-1-oxa-4,7,10,13-tetrazacyclohexadecane-2,5,8,11,14-pentone |
Molecular Mass | 556.694 g·mol−1 |
Heat of Formation | -1204.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 6.36 ± 1.08 D |
Volume | 716.51 Å 3 |
Surface Area | 495.04 Å 2 |
HOMO Energy | -9.33 ± 0.55 eV |
LUMO Energy | -0.46 ± eV |
Point Group Symmetry | C1 |
InChIKey | SMWGFJCKWZCJNQ-VTKBYMJVSA-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 |