Formula |
C25H26N4O4 |
IUPAC Name |
[azaniumylidene-[3-[(2s,3r)-2-methoxycarbonyl-3-[[4-(1-oxo-2h-pyridin-1-ium-2-ylium-4-yl)benzoyl]amino]butyl]phenyl]methyl]azanide |
Molecular Mass |
446.498 g·mol−1 |
Heat of Formation |
-239.7 ± 16.7 kJ·mol−1 |
Dipole Moment |
2.04 ± 1.08 D |
Volume |
540.68 Å 3 |
Surface Area |
457.13 Å 2 |
HOMO Energy |
-9.15 ± 0.55 eV |
LUMO Energy |
1.94 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
PFGVNLZDWRZPJW-ZHRRBRCNSA-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
|
|
|