Geometry & MOs

Info

ID:

2143

PubChem CID:

5989

Reduced:

ClNC5H11 (1)

Stoich.:

ABC5D11 (1)

Weight, g/mol:

120.058002

ΔHf, kcal/mol:

9.07

Dipole, Da:

2.0

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.754530

Charge, e:

 1

Chem-info

IUPAC name:

1-(2-chloroethyl)-1-methylaziridin-1-ium

Drug info:

PubChemData

Smile

C[N+]1(CC1)CCCl

DOS

IR

Vibrations