Geometry & MOs

Info

ID:	129766
PubChem CID:	51073773
Reduced:	ON2C12H18 (1)
Stoich.:	AB2C12D18 (1)
Weight, g/mol:	226.204513
ΔH_f, kcal/mol:	-38.22
Dipole, Da:	3.17
IP(EA), eV:	-9.6(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylpiperidin-1-yl)-N-(2-methylpropyl)propanamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C2(CCCC2)C#N

DOS

IR

Vibrations