Geometry & MOs
Info
ID: |
193142 |
PubChem CID: |
78349907 |
Reduced: |
SN4O8C16H18 (1) |
Stoich.: |
AB4C8D16E18 (1) |
Weight, g/mol: |
1091.516185 |
ΔHf, kcal/mol: |
-229.3 |
Dipole, Da: |
3.83 |
IP(EA), eV: |
-9.67(-1.13) |
Spin(Sz, S2): |
None, None |
Charge, e: |
1 |
Chem-info
IUPAC name:
[1-[[4-amino-1-[2-[[2-[[3-carboxy-1-[[1-[[2-[[2-[[1-(1-carboxypentylamino)-3-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-2-oxoethyl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-2-oxoethyl]carbamoyl]pyrrolidin-1-yl]-1,4-dioxobutan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]azanium