Geometry & MOs

Info

ID:	153964
PubChem CID:	56313320
Reduced:	FSN3O4H20C22 (1)
Stoich.:	ABC3D4E20F22 (1)
Weight, g/mol:	432.223592
ΔH_f, kcal/mol:	-107.92
Dipole, Da:	4.67
IP(EA), eV:	-9.12(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-methoxy-4-(2,2,2-trifluoroethoxy)phenyl]-N-[[4-(2-methylpropyl)morpholin-2-yl]methyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)NC(=O)/C=C/C2=CC(=C(C=C2)OC3=CN=CC=C3)F)S(=O)(=O)N

DOS

IR

Vibrations