Geometry & MOs

Info

ID:	23193
PubChem CID:	602747
Reduced:	NOCl2C9H9 (1)
Stoich.:	ABC2D9E9 (1)
Weight, g/mol:	217.006119
ΔH_f, kcal/mol:	-42.19
Dipole, Da:	3.63
IP(EA), eV:	-9.79(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-[(3-chlorophenyl)methyl]acetamide

Drug info:

PubChemData

Smile

C1=CC(=CC(=C1)Cl)CNC(=O)CCl

DOS

IR

Vibrations