Geometry & MOs
Info
ID: |
444880 |
PubChem CID: |
135263799 |
Reduced: |
NSO2C11H15 (1) |
Stoich.: |
ABC2D11E15 (1) |
Weight, g/mol: |
954.37075 |
ΔHf, kcal/mol: |
-39.88 |
Dipole, Da: |
2.08 |
IP(EA), eV: |
-8.6(-0.75) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S,4S)-1-[(2S)-2-[[2-[2-[2-[2-[4-[[2-(4-fluorophenyl)-6-hydroxy-1-benzothiophen-3-yl]oxy]phenoxy]ethoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutyl]-4-hydroxy-N-[2-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide