Geometry & MOs

Info

ID:	139780
PubChem CID:	52594546
Reduced:	BrON2C18H21 (1)
Stoich.:	ABC2D18E21 (1)
Weight, g/mol:	379.225977
ΔH_f, kcal/mol:	-12.95
Dipole, Da:	6.11
IP(EA), eV:	-8.78(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(diethylcarbamoyl)phenyl]-4-phenylpiperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCCN(CC1=CC=CC=C1)C(=O)NC2=C(C=C(C=C2)Br)C

DOS

IR

Vibrations