Geometry & MOs

Info

ID:	39489
PubChem CID:	8140985
Reduced:	Cl2N2O3H16C17 (1)
Stoich.:	A2B2C3D16E17 (1)
Weight, g/mol:	410.00328
ΔH_f, kcal/mol:	-90.32
Dipole, Da:	6.84
IP(EA), eV:	-8.79(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(4-bromophenoxy)acetyl]-methylamino]-N-(4-chlorophenyl)acetamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1=CC=C(C=C1)Cl)C(=O)COC2=CC=CC=C2Cl

DOS

IR

Vibrations