Geometry & MOs
Info
ID: |
446852 |
PubChem CID: |
135278211 |
Reduced: |
BrN2O3C26H39 (1) |
Stoich.: |
AB2C3D26E39 (1) |
Weight, g/mol: |
984.320464 |
ΔHf, kcal/mol: |
-91.04 |
Dipole, Da: |
4.24 |
IP(EA), eV: |
-8.21(-0.53) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S,4R)-1-[(2S)-2-[[2-[2-[2-[2-[4-[[2-(4-chlorophenyl)-6-hydroxy-1-benzothiophen-3-yl]oxy]phenoxy]ethoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxy-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide