Geometry & MOs
Info
ID: |
226761 |
PubChem CID: |
87558162 |
Reduced: |
NO2C8H18 (1) |
Stoich.: |
AB2C8D18 (1) |
Weight, g/mol: |
1158.683855 |
ΔHf, kcal/mol: |
-83.06 |
Dipole, Da: |
3.25 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.753638 |
Charge, e: |
0 |
Chem-info
IUPAC name:
2-tert-butyl-4-(3-tert-butyl-4-hydroxy-5-methylphenyl)sulfanyl-6-methylphenol;2-tert-butyl-4-(5-tert-butyl-4-hydroxy-2-methylphenyl)sulfanyl-5-methylphenol;2-(2-hydroxy-5-octylphenyl)sulfanyl-4-octylphenol