Geometry & MOs

Info

ID:	194643
PubChem CID:	78567530
Reduced:	OSN2C21H22 (1)
Stoich.:	ABC2D21E22 (1)
Weight, g/mol:	392.05169
ΔH_f, kcal/mol:	27.24
Dipole, Da:	6.19
IP(EA), eV:	-8.62(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3,4-dichlorophenyl)-[4-ethyl-2-(3-methylphenyl)imino-1,3-thiazolidin-3-yl]methanone

Drug info:

PubChemData

Smile

CCC1CSC(=NC2=CC=CC(=C2)C)N1C(=O)C=CC3=CC=CC=C3

DOS

IR

Vibrations