3-(1,3-Benzodioxol-5-Yl)-1-Methyl-1H-Pyrazol-5-Amine
Properties
Property | Value |
---|---|
Formula | C11H11N3O2 |
IUPAC Name | 5-(1,3-benzodioxol-5-yl)-2-methyl-pyrazol-3-amine |
Molecular Mass | 217.224 g·mol−1 |
Heat of Formation | 46.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.71 ± 1.08 D |
Volume | 245.43 Å 3 |
Surface Area | 238.93 Å 2 |
HOMO Energy | -8.37 ± 0.55 eV |
LUMO Energy | 2.84 ± eV |
Point Group Symmetry | C1 |
InChIKey | AHTNDUQVQKCVGH-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 |