4-(6-Oxo-1,4,5,6-Tetrahydro-3-Pyridazinyl)Benzyl 2,6-Dimethyl-5-Nitro-4-(3-Nitrophenyl)-1,4-Dihydro-3-Pyridinecarboxylate
Properties
Property | Value |
---|---|
Formula | C25H23N5O7 |
IUPAC Name | [4-(6-oxo-4,5-dihydro-1h-pyridazin-3-yl)phenyl]methyl (4r)-2,6-dimethyl-5-nitro-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylate |
Molecular Mass | 505.479 g·mol−1 |
Heat of Formation | -250.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 10.66 ± 1.08 D |
Volume | 569.04 Å 3 |
Surface Area | 463.87 Å 2 |
HOMO Energy | -9.38 ± 0.55 eV |
LUMO Energy | 1.72 ± eV |
Point Group Symmetry | C1 |
InChIKey | AJYGWAOLKKWVEB-QHCPKHFHSA-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 |