Geometry & MOs
Info
ID: |
321973 |
PubChem CID: |
126667613 |
Reduced: |
INH12C17 (1) |
Stoich.: |
ABC12D17 (1) |
Weight, g/mol: |
1644.431571 |
ΔHf, kcal/mol: |
178.85 |
Dipole, Da: |
5.46 |
IP(EA), eV: |
-8.7(-1.47) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
2',7'-bis[[5-[bis(carboxymethyl)amino]-4-[(1S,2R)-2-[2-[bis(carboxymethyl)amino]-5-methoxyphenoxy]cyclopentyl]oxy-2-nitrophenyl]methoxy]-3',6'-difluoro-9',9'-dimethyl-3-oxospiro[2-benzofuran-1,10'-anthracene]-5-carboxylic acid