Geometry & MOs

Info

ID:	211543
PubChem CID:	81044351
Reduced:	ON2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	209.152812
ΔH_f, kcal/mol:	-34.52
Dipole, Da:	4.19
IP(EA), eV:	-9.15(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyanomethyl)-3-piperidin-3-ylbutanamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1=NN=C(O1)C2CC2)C3CCCNC3

DOS

IR

Vibrations