Geometry & MOs
Info
ID: |
134236 |
PubChem CID: |
51666206 |
Reduced: |
NO2C10H14 (1) |
Stoich.: |
AB2C10D14 (1) |
Weight, g/mol: |
485.241352 |
ΔHf, kcal/mol: |
-38.02 |
Dipole, Da: |
3.49 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.754203 |
Charge, e: |
0 |
Chem-info
IUPAC name:
6-O-methyl 3-O-(2-propoxyethyl) (4S,6R,7R)-4-(3-ethoxyphenyl)-2,7-dimethyl-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3,6-dicarboxylate