Geometry & MOs

Info

ID:	446156
PubChem CID:	135272774
Reduced:	NC6H8 (2)
Stoich.:	AB6C8 (2)
Weight, g/mol:	207.125929
ΔH_f, kcal/mol:	26.09
Dipole, Da:	5.15
IP(EA), eV:	-9.76(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethyloxolan-3-yl)-6-methyl-1-oxidopyridin-1-ium

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)C(C)(C)C(C)C#N

DOS

IR

Vibrations