Geometry & MOs
Info
ID: |
141696 |
PubChem CID: |
52918088 |
Reduced: |
O2C15H22 (1) |
Stoich.: |
A2B15C22 (1) |
Weight, g/mol: |
768.298842 |
ΔHf, kcal/mol: |
-81.31 |
Dipole, Da: |
1.88 |
IP(EA), eV: |
-9.31(-0.44) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
1-(3,5-dimethylpyrazol-1-yl)-2-[[5-[4-[5-[2-(3,5-dimethylpyrazol-1-yl)-2-oxoethyl]sulfanyl-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]butyl]-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanone