Geometry & MOs

Info

ID:	4205
PubChem CID:	10963
Reduced:	ClNC3H4 (1)
Stoich.:	ABC3D4 (1)
Weight, g/mol:	89.003227
ΔH_f, kcal/mol:	10.71
Dipole, Da:	1.69
IP(EA), eV:	-11.16(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloropropanenitrile

Drug info:

PubChemData

Smile

C(CCl)C#N

DOS

IR

Vibrations