Geometry & MOs
Info
ID: |
160886 |
PubChem CID: |
57390129 |
Reduced: |
N4C15H20 (1) |
Stoich.: |
A4B15C20 (1) |
Weight, g/mol: |
727.262876 |
ΔHf, kcal/mol: |
41.63 |
Dipole, Da: |
2.73 |
IP(EA), eV: |
-8.62(-0.02) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[(1R,2R)-10-cyano-6-methoxy-3,3-dimethyl-7-oxo-2-(4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl)oxy-1,2-dihydropyrano[2,3-c]xanthen-1-yl] 4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carboxylate