Geometry & MOs

Info

ID:

171028

PubChem CID:

75314221

Reduced:

ClNS2O6H20C25 (1)

Stoich.:

ABC2D6E20F25 (1)

Weight, g/mol:

556.062648

ΔHf, kcal/mol:

-161.74

Dipole, Da:

9.24

IP(EA), eV:

 -9.13(-1.32)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[2-chloro-4-[[3-[(4-chlorophenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]-6-methoxyphenoxy]-N-(3-methylphenyl)acetamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC=C2OC)C=C3C(=O)N(C(=O)S3)CC4=CC=C(C=C4)Cl

DOS

IR

Vibrations