Geometry & MOs

Info

ID:	301974
PubChem CID:	123106113
Reduced:	BrClNSO2H13C15 (1)
Stoich.:	ABCDE2F13G15 (1)
Weight, g/mol:	365.085242
ΔH_f, kcal/mol:	-34.47
Dipole, Da:	3.19
IP(EA), eV:	-8.99(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-chlorophenyl)methylsulfinyl]-N-(4-ethoxyphenyl)propanamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CS(=O)CC(=O)NC2=CC=C(C=C2)Br

DOS

IR

Vibrations