Geometry & MOs

Info

ID:	87638
PubChem CID:	49896151
Reduced:	NSO2F3H14C19 (1)
Stoich.:	ABC2D3E14F19 (1)
Weight, g/mol:	502.156243
ΔH_f, kcal/mol:	-185.76
Dipole, Da:	4.8
IP(EA), eV:	-9.41(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-ethoxy-4-[(Z)-[3-[(4-methylphenyl)methyl]-2,4-dioxo-1,3-thiazolidin-5-ylidene]methyl]phenoxy]-N-phenylacetamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)CN2C(=O)/C(=C/C3=CC=CC=C3C(F)(F)F)/SC2=O

DOS

IR

Vibrations