Geometry & MOs

Info

ID:	2908
PubChem CID:	8816
Reduced:	BrNC21H38 (1)
Stoich.:	ABC21D38 (1)
Weight, g/mol:	383.21876
ΔH_f, kcal/mol:	-21.91
Dipole, Da:	18.33
IP(EA), eV:	-7.01(-2.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-hexadecylpyridin-1-ium;bromide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Br-]

DOS

IR

Vibrations