Formula |
C33H38FN3O5 |
IUPAC Name |
(3s)-3-[[(2s)-2-(2-adamantyloxycarbonylamino)-3-(2h-indol-1-ium-2-ylium-3-yl)-2-methyl-propanoyl]amino]-4-(4-fluorophenyl)butanoic acid |
Molecular Mass |
575.670 g·mol−1 |
Heat of Formation |
-1045.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
3.20 ± 1.08 D |
Volume |
683.64 Å 3 |
Surface Area |
515.6 Å 2 |
HOMO Energy |
-8.25 ± 0.55 eV |
LUMO Energy |
-0.49 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
UZOOGOCMUARFDV-QLJXUXPBSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
N
O
F
|
|
|