Geometry & MOs
Info
ID: |
437246 |
PubChem CID: |
135217953 |
Reduced: |
ClO3N6H13C17 (1) |
Stoich.: |
AB3C6D13E17 (1) |
Weight, g/mol: |
1425.62278 |
ΔHf, kcal/mol: |
14.13 |
Dipole, Da: |
8.75 |
IP(EA), eV: |
-9.36(-1.67) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[4-[[(2S)-2-[[2-[3-[2-[2-[2-[2-[2-[2-[2-[2-[3-(2,5-dioxopyrrol-1-yl)propanoylamino]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoylamino]acetyl]amino]propanoyl]amino]phenyl]methyl (6S,6aS)-6-hydroxy-2-methoxy-3-[3-[(2-methoxy-8-methyl-11-oxo-6a,7-dihydropyrrolo[2,1-c][1,4]benzodiazepin-3-yl)oxy]propoxy]-8-methyl-11-oxo-6a,7-dihydro-6H-pyrrolo[2,1-c][1,4]benzodiazepine-5-carboxylate