Geometry & MOs

Info

ID:	39482
PubChem CID:	8140954
Reduced:	ClN2O3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	330.113506
ΔH_f, kcal/mol:	-96.19
Dipole, Da:	6.79
IP(EA), eV:	-8.75(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-chloroanilino)-2-oxoethyl]-N,2,3-trimethylbenzamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(=O)N(C)CC(=O)NC2=CC=C(C=C2)Cl

DOS

IR

Vibrations