Geometry & MOs

Info

ID:	31192
PubChem CID:	855078
Reduced:	N2O2H18C21 (1)
Stoich.:	A2B2C18D21 (1)
Weight, g/mol:	244.089302
ΔH_f, kcal/mol:	-0.94
Dipole, Da:	6.47
IP(EA), eV:	-8.78(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-[2-(4-chlorophenyl)ethenyl]-1-ethylpyridin-1-ium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC2=CC=CC(=C2)[C@@H]3NC4=CC=CC=C4C(=O)N3

DOS

IR

Vibrations