Geometry & MOs
Info
ID: |
379061 |
PubChem CID: |
134352197 |
Reduced: |
NF3H10C11 (1) |
Stoich.: |
AB3C10D11 (1) |
Weight, g/mol: |
785.337769 |
ΔHf, kcal/mol: |
-130.66 |
Dipole, Da: |
3.63 |
IP(EA), eV: |
-8.59(-0.41) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-[2-[(E)-2-[(5E)-5-[[[3-(5-carboxypentyl)-1,1,7-trimethylbenzo[e]indol-2-ylidene]amino]methylidene]-4-chloro-1-methyl-2,6-dihydropyridin-3-yl]ethenyl]-3,3-dimethylpyrrolo[2,3-b]pyridin-7-ium-7-yl]butane-1-sulfonate