Geometry & MOs
Info
ID: |
421862 |
PubChem CID: |
135116742 |
Reduced: |
N3O3C16H25 (1) |
Stoich.: |
A3B3C16D25 (1) |
Weight, g/mol: |
718.405398 |
ΔHf, kcal/mol: |
-130.66 |
Dipole, Da: |
4.57 |
IP(EA), eV: |
-9.1(-0.46) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(7S,10R)-17-(1-acetylpiperidine-4-carbonyl)-4-[(2S)-butan-2-yl]-7-[(4-methoxyphenyl)methyl]-10-methyl-3,6,9,12,17-pentazabicyclo[17.2.2]tricosa-1(21),19,22-triene-2,5,8,11-tetrone