Geometry & MOs

Info

ID:	274002
PubChem CID:	103806441
Reduced:	SO2N3C14H17 (1)
Stoich.:	AB2C3D14E17 (1)
Weight, g/mol:	367.99272
ΔH_f, kcal/mol:	-42.13
Dipole, Da:	4.67
IP(EA), eV:	-8.64(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(2-aminoethoxy)phenyl]-2-bromo-4-chlorobenzamide

Drug info:

PubChemData

Smile

CC1=C(SC(=N1)C)C(=O)NC2=CC(=CC=C2)OCCN

DOS

IR

Vibrations