Geometry & MOs

Info

ID:	59958
PubChem CID:	26512256
Reduced:	NOC9H10 (2)
Stoich.:	ABC9D10 (2)
Weight, g/mol:	357.217818
ΔH_f, kcal/mol:	-3.2
Dipole, Da:	6.02
IP(EA), eV:	-8.69(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(2,4-dimethoxyphenyl)methyl-methyl-[2-oxo-2-(N-propan-2-ylanilino)ethyl]azanium

Drug info:

PubChemData

Smile

CN(CC1=CC=C(C=C1)C#N)CC2=C(C=C(C=C2)OC)OC

DOS

IR

Vibrations