Geometry & MOs
Info
ID: |
397797 |
PubChem CID: |
135030741 |
Reduced: |
ON2C12H14 (1) |
Stoich.: |
AB2C12D14 (1) |
Weight, g/mol: |
805.197989 |
ΔHf, kcal/mol: |
-3.02 |
Dipole, Da: |
3.62 |
IP(EA), eV: |
-8.7(-0.14) |
Spin(Sz, S2): |
None, None |
Charge, e: |
1 |
Chem-info
IUPAC name:
[7-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-8-yl]-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,8-dioxatricyclo[7.3.1.05,13]trideca-1(12),3,5(13),6,9-pentaen-11-ylidene]oxidanium