Geometry & MOs

Info

ID:	68588
PubChem CID:	46508708
Reduced:	SN5O5C19H19 (1)
Stoich.:	AB5C5D19E19 (1)
Weight, g/mol:	363.04701
ΔH_f, kcal/mol:	-89.38
Dipole, Da:	6.34
IP(EA), eV:	-9.14(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-bromo-3-methylphenyl)-2-(4-methoxyphenoxy)propanamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(NC(=O)NC1C2=CC=CO2)CSC3=NN=CN3CC4=CC=CO4

DOS

IR

Vibrations