Geometry & MOs

Info

ID:	153502
PubChem CID:	56312734
Reduced:	F3N3O3C20H22 (1)
Stoich.:	A3B3C3D20E22 (1)
Weight, g/mol:	476.088132
ΔH_f, kcal/mol:	-241.37
Dipole, Da:	3.45
IP(EA), eV:	-9.21(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,5-dichloro-4-methoxy-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]benzamide

Drug info:

PubChemData

Smile

CC(=O)C1=CNC(=C1)C(=O)NCC(C2=CC=C(C=C2)C(F)(F)F)N3CCOCC3

DOS

IR

Vibrations