2-{4-[3-(5H-Dibenzo[B,F]Azepin-5-Yl)Propyl]-1-Piperazinyl}Ethyl β-D-Glucopyranoside
Properties
Property | Value |
---|---|
Formula | C29H39N3O6 |
IUPAC Name | (2r,3r,4s,5s,6r)-2-[2-[4-(3-benzo[b][1]benzazepin-11-ylpropyl)piperazin-1-yl]ethoxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol |
Molecular Mass | 525.636 g·mol−1 |
Heat of Formation | -806.0 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.59 ± 1.08 D |
Volume | 639.74 Å 3 |
Surface Area | 519.52 Å 2 |
HOMO Energy | -8.86 ± 0.55 eV |
LUMO Energy | 2.47 ± eV |
Point Group Symmetry | C1 |
InChIKey | GVUGRCGKZRTSLY-XYPQWYOHSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |