Geometry & MOs

Info

ID:	154534
PubChem CID:	56313991
Reduced:	F3N3O3C26H34 (1)
Stoich.:	A3B3C3D26E34 (1)
Weight, g/mol:	452.228677
ΔH_f, kcal/mol:	-244.81
Dipole, Da:	4.74
IP(EA), eV:	-8.65(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[3-(diethylaminomethyl)phenyl]methyl]-3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]propanamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)CCC3=CC(=C(C=C3)OCC(F)(F)F)OC

DOS

IR

Vibrations