1-[1-(4-Methylphenyl)-3-(2-Methyl-2-Propanyl)-1H-Pyrazol-5-Yl]-3-[2-(4-Morpholinyl)Ethyl]Urea
Properties
Property | Value |
---|---|
Formula | C21H31N5O2 |
IUPAC Name | 1-[5-tert-butyl-2-(p-tolyl)-4h-pyrazol-2-ium-4-id-3-yl]-3-(2-morpholinoethyl)urea |
Molecular Mass | 385.503 g·mol−1 |
Heat of Formation | -134.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.78 ± 1.08 D |
Volume | 489.3 Å 3 |
Surface Area | 437.55 Å 2 |
HOMO Energy | -8.72 ± 0.55 eV |
LUMO Energy | 2.67 ± eV |
Point Group Symmetry | C1 |
InChIKey | WTTXDKWUUKCBRY-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 |