Geometry & MOs
Info
ID: |
312687 |
PubChem CID: |
126607348 |
Reduced: |
ClN3O3C26H32 (1) |
Stoich.: |
AB3C3D26E32 (1) |
Weight, g/mol: |
904.517909 |
ΔHf, kcal/mol: |
-67.61 |
Dipole, Da: |
5.49 |
IP(EA), eV: |
-7.87(-0.56) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
7-[3-(8-butan-2-yl-8-methyl-7-bicyclo[4.2.0]octa-1,3,5-trienyl)-3-methylpentyl]-18-(3,3,5,5,6-pentamethyl-4-phenyloctyl)-7,18-diazaheptacyclo[14.6.2.22,5.03,12.04,9.013,23.020,24]hexacosa-1(23),2,4,9,11,13,15,20(24),21,25-decaene-6,8,17,19-tetrone