Geometry & MOs

Info

ID:	175560
PubChem CID:	75921461
Reduced:	ClFN2O3C22H26 (1)
Stoich.:	ABC2D3E22F26 (1)
Weight, g/mol:	459.19582
ΔH_f, kcal/mol:	-146.41
Dipole, Da:	5.81
IP(EA), eV:	-8.83(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2-cyanophenyl)methoxy]-N-[2-(3-fluorophenyl)-2-morpholin-4-ylethyl]benzamide

Drug info:

PubChemData

Smile

CC(C)OC1=C(C=C(C=C1)Cl)C(=O)NCC(C2=CC(=CC=C2)F)N3CCOCC3

DOS

IR

Vibrations