Geometry & MOs
Info
ID: |
393496 |
PubChem CID: |
135020764 |
Reduced: |
IH8C21 (2) |
Stoich.: |
AB8C21 (2) |
Weight, g/mol: |
1367.363306 |
ΔHf, kcal/mol: |
178.22 |
Dipole, Da: |
0.11 |
IP(EA), eV: |
-8.34(-1.67) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
13-methyl-44-(44-methyl-13-heptadecacyclo[28.24.0.02,27.05,26.06,11.012,25.015,24.016,21.020,37.022,35.023,28.029,34.031,52.032,45.033,42.036,41.046,51]tetrapentaconta-1(30),2(27),3,5(26),6,8,10,12,14,16,18,20(37),21,23(28),24,29(34),31(52),32(45),33(42),35,38,40,43,46,48,50,53-heptacosaenyl)heptadecacyclo[28.24.0.02,27.05,26.06,11.012,25.015,24.016,21.020,37.022,35.023,28.029,34.031,52.032,45.033,42.036,41.046,51]tetrapentaconta-1(30),2(27),3,5(26),6,8,10,12(25),13,15(24),16,18,20(37),21,23(28),29(34),31(52),32,35,38,40,42,44,46,48,50,53-heptacosaene