Geometry & MOs
Info
ID: |
47320 |
PubChem CID: |
10531526 |
Reduced: |
SH2O3C11F20 (1) |
Stoich.: |
AB2C3D11E20 (1) |
Weight, g/mol: |
594.280198 |
ΔHf, kcal/mol: |
-1100.67 |
Dipole, Da: |
1.34 |
IP(EA), eV: |
-12.04(-2.12) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(3S,6R,12R)-7-[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]-6-(3-aminopropyl)-3-[(4-hydroxyphenyl)methyl]-1,4,7,10-tetrazabicyclo[10.3.0]pentadecane-2,5,8,11-tetrone