Geometry & MOs
Info
ID: |
400319 |
PubChem CID: |
135047563 |
Reduced: |
FeO3C19H25 (1) |
Stoich.: |
AB3C19D25 (1) |
Weight, g/mol: |
753.09765 |
ΔHf, kcal/mol: |
22.99 |
Dipole, Da: |
2.54 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 1.483472 |
Charge, e: |
0 |
Chem-info
IUPAC name:
azane;4-methyl-4-(3-oxobutyl)cyclohexa-2,5-dien-1-one;osmium(2+);trifluoromethanesulfonate