(1S)-1-(4-Nitropyrazol-2-Ium-1-Id-3-Yl)Ethanol
Properties
Property | Value |
---|---|
Formula | C5H7N3O3 |
IUPAC Name | (1s)-1-(4-nitro-1h-pyrazol-5-yl)ethanol |
Molecular Mass | 157.127 g·mol−1 |
Heat of Formation | -72.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.18 ± 1.08 D |
Volume | 171.44 Å 3 |
Surface Area | 170.37 Å 2 |
HOMO Energy | -10.73 ± 0.55 eV |
LUMO Energy | -0.93 ± eV |
Point Group Symmetry | C1 |
InChIKey | BXWVGCLWBHZMEZ-VKHMYHEASA-N |
QR Code | Generate QR Code |
Links | PubChem |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O N |