Geometry & MOs
Info
ID: |
390729 |
PubChem CID: |
135000601 |
Reduced: |
NOC23H38 (1) |
Stoich.: |
ABC23D38 (1) |
Weight, g/mol: |
324.08524 |
ΔHf, kcal/mol: |
-62.93 |
Dipole, Da: |
2.59 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.833798 |
Charge, e: |
0 |
Chem-info
IUPAC name:
diethyl-[1,1,1-trifluoro-3-(4-nitrophenyl)propan-2-ylidene]azanium;chloride