Geometry & MOs

Info

ID:

188931

PubChem CID:

77787025

Reduced:

SF2O5N6H34C35 (1)

Stoich.:

AB2C5D6E34F35 (1)

Weight, g/mol:

481.142278

ΔHf, kcal/mol:

-118.96

Dipole, Da:

5.96

IP(EA), eV:

 -9.27(-1.15)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

3-[3-[[[3-(2,4-dichlorophenyl)-1-hydroxy-2-methylprop-1-enyl]amino]methyl]-4-methoxyphenyl]-2-propan-2-yloxypropanoic acid

Drug info:

PubChemData

Smile

CC(C1=NC(=CS1)C2=CC=C(C=C2)C#N)C(CN3C=NC=N3)(C4=C(C=C(C=C4)F)F)OCOC(=O)C5=CC=CC(=C5)CN(CCO)CCO

DOS

IR

Vibrations