Geometry & MOs

Info

ID:	389659
PubChem CID:	134994336
Reduced:	N3O4C6H9 (1)
Stoich.:	A3B4C6D9 (1)
Weight, g/mol:	180.162649
ΔH_f, kcal/mol:	-61.11
Dipole, Da:	4.22
IP(EA), eV:	-10.91(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-5-piperidin-1-ylpentanenitrile

Drug info:

PubChemData

Smile

COC(=O)CN(CCC#N)[N+](=O)[O-]

DOS

IR

Vibrations