Geometry & MOs

Info

ID:	153938
PubChem CID:	56313288
Reduced:	FO2N3C22H28 (1)
Stoich.:	AB2C3D22E28 (1)
Weight, g/mol:	408.241293
ΔH_f, kcal/mol:	-118.41
Dipole, Da:	0.48
IP(EA), eV:	-8.86(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-phenoxypropanoyl)-N-(3-phenylbutyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NCC(C)(C)C1=CC=CC=C1F)NC(=O)NC2=CC=CC=C2

DOS

IR

Vibrations