Geometry & MOs
Info
ID: |
162892 |
PubChem CID: |
57578287 |
Reduced: |
N2S2C21H23 (1) |
Stoich.: |
A2B2C21D23 (1) |
Weight, g/mol: |
603.298961 |
ΔHf, kcal/mol: |
64.14 |
Dipole, Da: |
2.2 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.037454 |
Charge, e: |
1 |
Chem-info
IUPAC name:
[(2Z)-2-[(2E)-2-[2-chloro-3-[(E)-2-(5,6-dimethoxy-1,3,3-trimethylindol-1-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-5-methoxy-1,3,3-trimethylindol-6-yl]methanol