Geometry & MOs

Info

ID:	194641
PubChem CID:	78567528
Reduced:	ClOSN2C19H19 (1)
Stoich.:	ABCD2E19F19 (1)
Weight, g/mol:	340.124549
ΔH_f, kcal/mol:	2.72
Dipole, Da:	1.19
IP(EA), eV:	-8.93(-0.77)
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-(furan-2-yl)prop-2-en-1-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations