Geometry & MOs
Info
ID: |
322840 |
PubChem CID: |
126671382 |
Reduced: |
OSN4C22H24 (1) |
Stoich.: |
ABC4D22E24 (1) |
Weight, g/mol: |
1087.465967 |
ΔHf, kcal/mol: |
53.48 |
Dipole, Da: |
10.06 |
IP(EA), eV: |
-9.08(-1.31) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
tert-butyl N-[(2S)-1-[(2S,4R)-2-[[2-[2-[3-[4-[(9S)-9-(2-anilino-2-oxoethyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-7-yl]phenoxy]propoxy]ethoxy]-4-(4-methyl-1,3-thiazol-5-yl)phenyl]methylcarbamoyl]-4-hydroxypyrrolidin-1-yl]-3,3-dimethyl-1-oxobutan-2-yl]carbamate