| Formula |
C33H37F3N4O4 |
| IUPAC Name |
n-[(1s,2r)-1-benzyl-2-hydroxy-3-[[3-(trifluoromethyl)phenyl]methylamino]propyl]-1-cyclopentyl-6-oxo-5-(2-oxopyrrolidin-1-yl)pyridin-1-ium-5-ylium-3-carboxamide |
| Molecular Mass |
610.666 g·mol−1 |
| Heat of Formation |
-1201.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
5.47 ± 1.08 D |
| Volume |
717.58 Å 3 |
| Surface Area |
566.06 Å 2 |
| HOMO Energy |
-8.38 ± 0.55 eV |
| LUMO Energy |
-0.54 ± eV |
| Point Group Symmetry |
C1
|
| InChIKey |
QKLJNYJRYSKKKP-LMSSTIIKSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
C
F
O
N
|
| |
|
