Geometry & MOs

Info

ID:	46302
PubChem CID:	10523795
Reduced:	IN2C17H21 (1)
Stoich.:	AB2C17D21 (1)
Weight, g/mol:	253.170474
ΔH_f, kcal/mol:	80.68
Dipole, Da:	6.54
IP(EA), eV:	-7.21(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

N,N,2-trimethyl-4-[(E)-2-(1-methylpyridin-1-ium-2-yl)ethenyl]aniline

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)/C=C/C2=CC=CC=[N+]2C)N(C)C.[I-]

DOS

IR

Vibrations