Geometry & MOs

Info

ID:

179054

PubChem CID:

76427819

Reduced:

ClSO3N7C19H24 (1)

Stoich.:

ABC3D7E19F24 (1)

Weight, g/mol:

914.587703

ΔHf, kcal/mol:

43.96

Dipole, Da:

5.21

IP(EA), eV:

 -9.04(-1.09)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[3-[3-amino-4-[(3-hydroxy-1-methoxy-1-oxopropan-2-yl)amino]-2-methyl-4-oxobutan-2-yl]sulfanyl-2-hexadecanoyloxypropyl] hexadecanoate;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)C(=O)NN2CN(C(=N[N+](=O)[O-])N(C2)CC3=CN=C(S3)Cl)C

DOS

IR

Vibrations