Geometry & MOs

Info

ID:	251271
PubChem CID:	103102658
Reduced:	BrN2O2C12H15 (1)
Stoich.:	AB2C2D12E15 (1)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-74.35
Dipole, Da:	1.56
IP(EA), eV:	-9.79(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-2-oxoethyl)-N-ethyl-6-methylpiperidine-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=CC(=C(C=C1)C)Br

DOS

IR

Vibrations