Geometry & MOs
Info
ID: |
422009 |
PubChem CID: |
135117004 |
Reduced: |
O2N5C19H29 (1) |
Stoich.: |
A2B5C19D29 (1) |
Weight, g/mol: |
698.379183 |
ΔHf, kcal/mol: |
-52.31 |
Dipole, Da: |
1.63 |
IP(EA), eV: |
-8.74(0.15) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(4R,7S,10R)-17-(5-acetyl-2,4-dimethyl-1H-pyrrole-3-carbonyl)-4-benzyl-10-methyl-7-(2-methylpropyl)-3,6,9,12,17-pentazabicyclo[17.2.2]tricosa-1(21),19,22-triene-2,5,8,11-tetrone