Geometry & MOs

Info

ID:	65239
PubChem CID:	29204656
Reduced:	SF3N3O4H16C19 (1)
Stoich.:	AB3C3D4E16F19 (1)
Weight, g/mol:	398.091198
ΔH_f, kcal/mol:	-242.73
Dipole, Da:	4.67
IP(EA), eV:	-9.54(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(dimethylamino)-2-oxoethyl]sulfanyl-N-[4-(trifluoromethoxy)phenyl]benzamide

Drug info:

PubChemData

Smile

C1C[C@H](N(C1)C2=NS(=O)(=O)C3=CC=CC=C32)C(=O)NC4=CC=C(C=C4)OC(F)(F)F

DOS

IR

Vibrations