Geometry & MOs

Info

ID:	62881
PubChem CID:	26737412
Reduced:	FSN2O4H23C26 (1)
Stoich.:	ABC2D4E23F26 (1)
Weight, g/mol:	487.120192
ΔH_f, kcal/mol:	-128.35
Dipole, Da:	6.5
IP(EA), eV:	-8.15(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]-N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]benzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)NC(=O)C3=C(C4=C(C=CC=C4S3)F)COC

DOS

IR

Vibrations