Geometry & MOs
Info
ID: |
322878 |
PubChem CID: |
126671512 |
Reduced: |
NSO2C15H31 (1) |
Stoich.: |
ABC2D15E31 (1) |
Weight, g/mol: |
986.424813 |
ΔHf, kcal/mol: |
-126.15 |
Dipole, Da: |
2.54 |
IP(EA), eV: |
-8.64(0.66) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl (2S,4R)-1-[(2S)-2-[[2-[3-[2-[5-carbamoyl-9-(cyclohexa-1,3-dien-1-ylmethyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)carbazol-3-yl]oxyethoxy]propoxy]acetyl]amino]-3,3-dimethylbutanoyl]-4-hydroxypyrrolidine-2-carboxylate