Geometry & MOs

Info

ID:	58445
PubChem CID:	24701464
Reduced:	ON3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	275.163377
ΔH_f, kcal/mol:	1.97
Dipole, Da:	4.22
IP(EA), eV:	-8.91(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-amino-3-phenylpropanoyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N)CC2=CC(=CC=C2)C#N

DOS

IR

Vibrations