Geometry & MOs

Info

ID:	406812
PubChem CID:	135078680
Reduced:	NO5C21H23 (1)
Stoich.:	AB5C21D23 (1)
Weight, g/mol:	317.118257
ΔH_f, kcal/mol:	-142.07
Dipole, Da:	2.27
IP(EA), eV:	-8.44(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-N-(3,5-dimethylphenyl)-N-[(4-methoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)OC)C2=CC=CC=C2C=C(C(=O)OC)C(=O)OC

DOS

IR

Vibrations