2-[(2-Nitrophenyl)Sulfanyl]-5-Phenyl-1,3-Cyclohexanedione
Properties
Property | Value |
---|---|
Formula | C18H15NO4S |
IUPAC Name | 2-(2-nitrophenyl)sulfanyl-5-phenyl-cyclohexane-1,3-dione |
Molecular Mass | 341.381 g·mol−1 |
Heat of Formation | -128.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.24 ± 1.08 D |
Volume | 375.77 Å 3 |
Surface Area | 311.84 Å 2 |
HOMO Energy | -8.94 ± 0.55 eV |
LUMO Energy | 1.74 ± eV |
Point Group Symmetry | C1 |
InChIKey | CVKXTYKGXUQQPQ-KTXOBNNYSA-N |
QR Code | Generate QR Code |
Links | ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |