Geometry & MOs

Info

ID:	154386
PubChem CID:	56313809
Reduced:	ClN2O2C21H23 (1)
Stoich.:	AB2C2D21E23 (1)
Weight, g/mol:	354.173213
ΔH_f, kcal/mol:	-65.02
Dipole, Da:	2.06
IP(EA), eV:	-9.46(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyanophenyl)-N-(3-phenylbutyl)benzamide

Drug info:

PubChemData

Smile

CC(CCNC(=O)C1=C(C=C(C=C1)Cl)N2CCCC2=O)C3=CC=CC=C3

DOS

IR

Vibrations