Geometry & MOs

Info

ID:	154293
PubChem CID:	56313706
Reduced:	FO2N3C26H28 (1)
Stoich.:	AB2C3D26E28 (1)
Weight, g/mol:	464.228677
ΔH_f, kcal/mol:	-32.42
Dipole, Da:	1.32
IP(EA), eV:	-8.54(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)CC1=CC=CC=C1CNC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F

DOS

IR

Vibrations