5-Amino-N-[2-Methyl-5-(1,2-Oxazol-3-Ylcarbamoyl)Phenyl]-1-Phenyl-1H-Pyrazole-4-Carboxamide
Properties
Property | Value |
---|---|
Formula | C21H18N6O3 |
IUPAC Name | 5-amino-n-[5-(isoxazol-3-ylcarbamoyl)-2-methyl-phenyl]-1-phenyl-pyrazole-4-carboxamide |
Molecular Mass | 402.406 g·mol−1 |
Heat of Formation | 151.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.42 ± 1.08 D |
Volume | 451.73 Å 3 |
Surface Area | 412.68 Å 2 |
HOMO Energy | -8.94 ± 0.55 eV |
LUMO Energy | -0.72 ± eV |
Point Group Symmetry | C1 |
InChIKey | DMYYPSLMFSEFCK-UHFFFAOYSA-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 |