Geometry & MOs
Info
ID: |
127520 |
PubChem CID: |
51004696 |
Reduced: |
ClOC11H17 (1) |
Stoich.: |
ABC11D17 (1) |
Weight, g/mol: |
726.204239 |
ΔHf, kcal/mol: |
-70.57 |
Dipole, Da: |
2.09 |
IP(EA), eV: |
-9.54(0.7) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(1R,5R,12S,16R)-7,10-dimethoxytridecacyclo[14.14.6.65,12.620,27.02,15.04,13.06,11.017,30.019,28.021,26.031,36.037,42.043,48]octatetraconta-2(15),4(13),6,8,10,17(30),19(28),21,23,25,31,33,35,37,39,41,43,45,47-nonadecaene-3,14,18,29-tetrone