Geometry & MOs

Info

ID:

88027

PubChem CID:

49900027

Reduced:

SCl2N2O4H22C26 (1)

Stoich.:

AB2C2D4E22F26 (1)

Weight, g/mol:

566.187543

ΔHf, kcal/mol:

-115.95

Dipole, Da:

8.81

IP(EA), eV:

 -8.84(-1.36)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-(2,5-dimethylphenyl)-2-[2-ethoxy-4-[(Z)-[3-(naphthalen-2-ylmethyl)-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC=C(C=C1)N2C(=CC(=C2C)/C=C\3/C(=O)N(C(=O)S3)CC4=CC(=C(C=C4)Cl)Cl)C

DOS

IR

Vibrations