Geometry & MOs
Info
ID: |
340853 |
PubChem CID: |
127263288 |
Reduced: |
O2N3C11H11 (1) |
Stoich.: |
A2B3C11D11 (1) |
Weight, g/mol: |
656.156362 |
ΔHf, kcal/mol: |
59.58 |
Dipole, Da: |
8.58 |
IP(EA), eV: |
-9.6(-1.47) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(5S,5aR,8aR,9S)-5-[[(4aR,7R,8R,8aS)-7,8-dihydroxy-2-thiophen-2-yl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-6-yl]oxy]-9-(4-hydroxy-3,5-dimethoxyphenyl)-5a,6,8a,9-tetrahydro-5H-[2]benzofuro[6,5-f][1,3]benzodioxol-8-one