Geometry & MOs

Info

ID:	142560
PubChem CID:	53057868
Reduced:	BrO2N3C19H26 (1)
Stoich.:	AB2C3D19E26 (1)
Weight, g/mol:	411.215806
ΔH_f, kcal/mol:	-89.63
Dipole, Da:	4.69
IP(EA), eV:	-8.86(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(2,4-dimethoxyanilino)-1-oxopropan-2-yl]-N-phenylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CC2CCN(CC2)C(=O)NC3=CC=CC=C3Br

DOS

IR

Vibrations