Geometry & MOs
Info
ID: |
441037 |
PubChem CID: |
135232788 |
Reduced: |
N5C8H9 (1) |
Stoich.: |
A5B8C9 (1) |
Weight, g/mol: |
812.353674 |
ΔHf, kcal/mol: |
83.23 |
Dipole, Da: |
2.88 |
IP(EA), eV: |
-8.19(-0.55) |
Spin(Sz, S2): |
None, None |
Charge, e: |
1 |
Chem-info
IUPAC name:
[(E)-3-[6-[2-[(E,3Z)-3-(3,3-dimethyl-1H-indol-2-ylidene)prop-1-enyl]-3,3-dimethylindol-1-ium-1-yl]hexylamino]-3-oxoprop-1-enyl] [3-hydroxy-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]methyl hydrogen phosphate