Geometry & MOs
Info
ID: |
380885 |
PubChem CID: |
134971468 |
Reduced: |
BrH6C9 (1) |
Stoich.: |
AB6C9 (1) |
Weight, g/mol: |
230.115424 |
ΔHf, kcal/mol: |
65.5 |
Dipole, Da: |
1.8 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.992311 |
Charge, e: |
0 |
Chem-info
IUPAC name:
(3aR,6R)-2,2-dimethyl-6-prop-2-enoxy-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-ol