(13Xi,16β)-20-Ethyl-1,16-Dimethoxy-4-(Methoxymethyl)Aconitane-8,14-Diol
Properties
Property | Value |
---|---|
Formula | C24H39NO5 |
IUPAC Name | (1alpha,5xi,9xi,10xi,14alpha,16beta)-20-ethyl-1,16-dimethoxy-4-(methoxymethyl)aconitane-8,14-diol |
Molecular Mass | 421.570 g·mol−1 |
Heat of Formation | -510.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.40 ± 1.08 D |
Volume | 509.32 Å 3 |
Surface Area | 377.46 Å 2 |
HOMO Energy | -8.23 ± 0.55 eV |
LUMO Energy | 5.18 ± eV |
Point Group Symmetry | C1 |
InChIKey | BDCURAWBZJMFIK-XFFYPZHLSA-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 |