Geometry & MOs

Info

ID:	269032
PubChem CID:	103606670
Reduced:	N2S2O3C13H16 (1)
Stoich.:	A2B2C3D13E16 (1)
Weight, g/mol:	330.05791
ΔH_f, kcal/mol:	-72.89
Dipole, Da:	3.67
IP(EA), eV:	-8.5(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[5-bromo-2-(dimethylamino)phenyl]-2-(2-methoxyethoxy)acetamide

Drug info:

PubChemData

Smile

COCCOCC(=O)NC1=CC2=C(C=C1)N=C(S2)SC

DOS

IR

Vibrations