Geometry & MOs
Info
ID: |
320106 |
PubChem CID: |
126658260 |
Reduced: |
NC9H17 (1) |
Stoich.: |
AB9C17 (1) |
Weight, g/mol: |
1133.492177 |
ΔHf, kcal/mol: |
-7.97 |
Dipole, Da: |
2.0 |
IP(EA), eV: |
-7.81(1.04) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
methyl N-[(2S,3R)-1-[(2S)-2-[6-[(2S,5S)-1-[4-[4-(2,6-difluorophenyl)piperazin-1-yl]-3,5-difluorophenyl]-5-[6-fluoro-2-[1-[(2S,3R)-2-[[hydroxy(methoxy)methyl]amino]-3-methoxybutanoyl]pyrrolidin-2-yl]-3H-benzimidazol-5-yl]pyrrolidin-2-yl]-5-fluoro-1H-benzimidazol-2-yl]pyrrolidin-1-yl]-3-methoxy-1-oxobutan-2-yl]carbamate