Geometry & MOs

Info

ID:	39157
PubChem CID:	8139811
Reduced:	N2O3C20H20 (1)
Stoich.:	A2B3C20D20 (1)
Weight, g/mol:	297.196688
ΔH_f, kcal/mol:	-61.64
Dipole, Da:	2.48
IP(EA), eV:	-8.84(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[2-[[(3,4-dimethylbenzoyl)amino]methyl]phenyl]methyl-dimethylazanium

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)C2=CC3=CC=CC=C3OC2=O

DOS

IR

Vibrations