Geometry & MOs
Info
ID: |
48121 |
PubChem CID: |
10537312 |
Reduced: |
OPH12C14 (1) |
Stoich.: |
ABC12D14 (1) |
Weight, g/mol: |
228.078644 |
ΔHf, kcal/mol: |
4.64 |
Dipole, Da: |
5.02 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.052838 |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1S,11R)-6-oxatetracyclo[9.2.2.02,10.04,8]pentadeca-2,9,12-triene-5,7-dione