Geometry & MOs
Info
ID: |
159472 |
PubChem CID: |
57288085 |
Reduced: |
N3O4C9H12 (1) |
Stoich.: |
A3B4C9D12 (1) |
Weight, g/mol: |
249.103479 |
ΔHf, kcal/mol: |
-120.93 |
Dipole, Da: |
2.97 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.951368 |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-amino-3-hydroxy-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene-1-sulfonic acid