(2S)-N~1~-[5-(1H-Indazol-5-Yl)-1,3,4-Thiadiazol-2-Yl]-3-(4-Methylphenyl)-1,2-Propanediamine
Properties
Property | Value |
---|---|
Formula | C19H20N6S |
IUPAC Name | (2s)-n1-(5-indazol-1-ium-5-yl-1,3,4-thiadiazol-2-yl)-3-(p-tolyl)propane-1,2-diamine |
Molecular Mass | 364.467 g·mol−1 |
Heat of Formation | 547.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.90 ± 1.08 D |
Volume | 434.53 Å 3 |
Surface Area | 391.42 Å 2 |
HOMO Energy | -8.69 ± 0.55 eV |
LUMO Energy | -1.35 ± eV |
Point Group Symmetry | C1 |
InChIKey | XFEMJTFDPFGXFN-INIZCTEOSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C S N |