Geometry & MOs

Info

ID:	140608
PubChem CID:	52729437
Reduced:	ClNSO2C17H18 (1)
Stoich.:	ABCD2E17F18 (1)
Weight, g/mol:	360.060235
ΔH_f, kcal/mol:	-59.81
Dipole, Da:	4.48
IP(EA), eV:	-8.86(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4,5-dihydro-1,3-thiazol-2-yl)-4-methylsulfonyl-N-phenylbenzamide

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)SCCC(=O)NC2=CC=C(C=C2)CCO)Cl

DOS

IR

Vibrations