Formula |
C28H25ClN6O6 |
IUPAC Name |
n-[4-chloro-5-[4-[3-(2-methoxyphenyl)-5-methyl-isoxazole-4-carbonyl]piperazin-1-yl]-2-nitro-phenyl]pyridine-2-carboxamide |
Molecular Mass |
576.988 g·mol−1 |
Heat of Formation |
-163.9 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.49 ± 1.08 D |
Volume |
633.64 Å 3 |
Surface Area |
474.42 Å 2 |
HOMO Energy |
-9.07 ± 0.55 eV |
LUMO Energy |
1.49 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
QSXDDWUUADOGGK-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
C
Cl
O
N
|
|
|