Geometry & MOs
Info
ID: |
312855 |
PubChem CID: |
126609247 |
Reduced: |
NO2C7H15 (2) |
Stoich.: |
AB2C7D15 (2) |
Weight, g/mol: |
721.253648 |
ΔHf, kcal/mol: |
-204.54 |
Dipole, Da: |
4.02 |
IP(EA), eV: |
-9.31(1.08) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(12aS)-8-methoxy-9-[[3-[(8-methyl-6-oxo-11,12,12a,13-tetrahydroindolo[2,1-c][1,4]benzodiazepin-9-yl)oxymethyl]-5-nitrophenyl]methoxy]-12a,13-dihydroindolo[2,1-c][1,4]benzodiazepin-6-one