2-(2-Nitrophenyl)Sulfanyl-5-Phenyl-Cyclohexane-1,3-Dione
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 | -111.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 8.26 ± 1.08 D |
Volume | 376.03 Å 3 |
Surface Area | 330.74 Å 2 |
HOMO Energy | -8.74 ± 0.55 eV |
LUMO Energy | -1.20 ± eV |
Point Group Symmetry | C1 |
InChIKey | VRNHYHQRLNRWFJ-KTXOBNNYSA-N |
QR Code | Generate QR Code |
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Elements | H C S O N |