Geometry & MOs

Info

ID:

15306

PubChem CID:

436984

Reduced:

NC13H20 (1)

Stoich.:

AB13C20 (1)

Weight, g/mol:

190.159575

ΔHf, kcal/mol:

35.26

Dipole, Da:

4.44

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.988363

Charge, e:

 1

Chem-info

IUPAC name:

1-benzyl-1-methylpiperidin-1-ium

Drug info:

PubChemData

Smile

C[N+]1(CCCCC1)CC2=CC=CC=C2

DOS

IR

Vibrations