Geometry & MOs
Info
ID: |
227879 |
PubChem CID: |
87562825 |
Reduced: |
AsCFeO3H6 (1) |
Stoich.: |
ABCD3E6 (1) |
Weight, g/mol: |
501.218305 |
ΔHf, kcal/mol: |
-62.85 |
Dipole, Da: |
2.57 |
IP(EA), eV: |
0.0(0.0) |
Spin(Sz, S2): |
0.500000, 0.830762 |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2R,4S)-2-[(3'S,5R)-2-chloro-3'-hydroxyspiro[7,8-dihydro-6H-quinoline-5,4'-pyrrolidine]-3'-yl]-2,4-diphenylpiperidine-1-carbaldehyde