Geometry & MOs

Info

ID:

219542

PubChem CID:

85149162

Reduced:

ISiO4C26H35 (1)

Stoich.:

ABC4D26E35 (1)

Weight, g/mol:

566.233641

ΔHf, kcal/mol:

-177.51

Dipole, Da:

2.59

IP(EA), eV:

 -8.97(-0.87)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-acetamido-4-[[1-[[1-[[1-carboxy-3-(4-hydroxy-N-nitrosoanilino)propan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-4-oxobutanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCC3CCCCC(C(O3)COC=O)I

DOS

IR

Vibrations