Geometry & MOs
Info
ID: |
433560 |
PubChem CID: |
135173700 |
Reduced: |
NOC11H15 (1) |
Stoich.: |
ABC11D15 (1) |
Weight, g/mol: |
1072.379852 |
ΔHf, kcal/mol: |
-23.09 |
Dipole, Da: |
0.81 |
IP(EA), eV: |
-8.9(0.02) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
(2S)-1-[(2S)-2-[[2-[2-[2-[4-[3-[2,6-difluoro-3-[[(3R)-3-fluoropyrrolidin-1-yl]sulfonylamino]benzoyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]phenoxy]ethoxy]ethoxy]acetyl]amino]-3,3-dimethylbutanoyl]-N-[(1S)-1-[4-(4-methyl-1,3-thiazol-5-yl)phenyl]ethyl]pyrrolidine-2-carboxamide