Geometry & MOs

Info

ID:	126030
PubChem CID:	50949005
Reduced:	SO2N3C21H23 (1)
Stoich.:	AB2C3D21E23 (1)
Weight, g/mol:	296.152478
ΔH_f, kcal/mol:	-3.66
Dipole, Da:	5.85
IP(EA), eV:	-8.87(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N'-(3,5-dimethylphenyl)propanediamide

Drug info:

PubChemData

Smile

CCN(CC1=CN=C(N=C1)C2=CC=CC3=CC=CC=C32)C4CCS(=O)(=O)C4

DOS

IR

Vibrations