Geometry & MOs

Info

ID:	194642
PubChem CID:	78567529
Reduced:	SN2O2C19H20 (1)
Stoich.:	AB2C2D19E20 (1)
Weight, g/mol:	350.145285
ΔH_f, kcal/mol:	-2.98
Dipole, Da:	6.04
IP(EA), eV:	-8.59(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-ethyl-2-(3-methylphenyl)imino-1,3-thiazolidin-3-yl]-3-phenylprop-2-en-1-one

Drug info:

PubChemData

Smile

CCC1CSC(=NC2=CC=CC(=C2)C)N1C(=O)C=CC3=CC=CO3

DOS

IR

Vibrations