Geometry & MOs
Info
ID: |
232612 |
PubChem CID: |
87576517 |
Reduced: |
NPbC8H18 (1) |
Stoich.: |
ABC8D18 (1) |
Weight, g/mol: |
366.171224 |
ΔHf, kcal/mol: |
8.31 |
Dipole, Da: |
3.03 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.814720 |
Charge, e: |
0 |
Chem-info
IUPAC name:
4,6-dimethyl-3-(4-methylpentan-2-yloxycarbonyl)-3-sulfoheptanoic acid