Geometry & MOs
Info
ID: |
324434 |
PubChem CID: |
126677668 |
Reduced: |
NSO3C10H17 (1) |
Stoich.: |
ABC3D10E17 (1) |
Weight, g/mol: |
619.241964 |
ΔHf, kcal/mol: |
-136.17 |
Dipole, Da: |
2.98 |
IP(EA), eV: |
-9.17(0.28) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
3-[[(2R,6R,9S,12R,13S)-12-butan-2-yl-9-[(but-3-enyldisulfanyl)methyl]-2-methyl-6-(2-methylsulfanylethyl)-4,7,10,15-tetraoxo-1-oxa-5,8,11-triazacyclopentadec-13-yl]oxy]propanal