5-Methyl-4-[(5-Nitro-2-Furyl)Methyl]-2-Phenyl-2,4-Dihydro-3H-Pyrazol-3-One
Properties
Property | Value |
---|---|
Formula | C15H13N3O4 |
IUPAC Name | (4r)-5-methyl-4-[(5-nitro-2-furyl)methyl]-2-phenyl-4h-pyrazol-3-one |
Molecular Mass | 299.281 g·mol−1 |
Heat of Formation | 47.4 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.19 ± 1.08 D |
Volume | 336.47 Å 3 |
Surface Area | 309.93 Å 2 |
HOMO Energy | -8.89 ± 0.55 eV |
LUMO Energy | 1.82 ± eV |
Point Group Symmetry | C1 |
InChIKey | OWENCHXOSLBDNG-CYBMUJFWSA-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 |