Geometry & MOs
Info
ID: |
319071 |
PubChem CID: |
126654442 |
Reduced: |
O4C13H16 (1) |
Stoich.: |
A4B13C16 (1) |
Weight, g/mol: |
760.398205 |
ΔHf, kcal/mol: |
-147.32 |
Dipole, Da: |
2.47 |
IP(EA), eV: |
-9.65(0.0) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S,4R)-1-[(2S)-3,3-dimethyl-2-[[2-[3-oxo-3-[4-(4-propan-2-ylphenyl)piperazin-1-yl]propoxy]acetyl]amino]butanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide