2-{[(4-Methoxy-3-Methyl-2-Pyridinyl)Methyl]Sulfinyl}-5,5,7,7-Tetramethyl-5,7-Dihydroindeno[5,6-D]Imidazol-6(1H)-One
Properties
Property | Value |
---|---|
Formula | C22H25N3O3S |
IUPAC Name | 2-[(r)-(4-methoxy-3-methyl-2-pyridyl)methylsulfinyl]-5,5,7,7-tetramethyl-cyclopenta[f]benzimidazol-3-ium-6-one |
Molecular Mass | 411.517 g·mol−1 |
Heat of Formation | -258.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.52 ± 1.08 D |
Volume | 485.47 Å 3 |
Surface Area | 410.02 Å 2 |
HOMO Energy | -8.91 ± 0.55 eV |
LUMO Energy | -0.59 ± eV |
Point Group Symmetry | C1 |
InChIKey | YBCJDBBYBFMVEG-GDLZYMKVSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |