Geometry & MOs

Info

ID:	338732
PubChem CID:	127259743
Reduced:	NOC18H28 (2)
Stoich.:	ABC18D28 (2)
Weight, g/mol:	462.3974
ΔH_f, kcal/mol:	-54.75
Dipole, Da:	10.21
IP(EA), eV:	-8.36(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-octadecyl-4-[(E)-2-pyridin-4-ylethenyl]aniline

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations