Geometry & MOs

Info

ID:	154654
PubChem CID:	56314141
Reduced:	O2F3N3C22H26 (1)
Stoich.:	A2B3C3D22E26 (1)
Weight, g/mol:	485.159612
ΔH_f, kcal/mol:	-194.0
Dipole, Da:	2.43
IP(EA), eV:	-8.67(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-5-(methylsulfamoyl)-N-[2-morpholin-4-yl-2-[4-(trifluoromethyl)phenyl]ethyl]benzamide

Drug info:

PubChemData

Smile

CN(CC(=O)NCC(C1=CC=C(C=C1)C(F)(F)F)N2CCOCC2)C3=CC=CC=C3

DOS

IR

Vibrations