Geometry & MOs

Info

ID:	301943
PubChem CID:	123101406
Reduced:	BrFNSO2C15H19 (1)
Stoich.:	ABCDE2F15G19 (1)
Weight, g/mol:	392.101763
ΔH_f, kcal/mol:	-113.0
Dipole, Da:	3.33
IP(EA), eV:	-8.98(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-morpholin-4-yl-2-oxoethyl)sulfinyl-N-[2-(trifluoromethyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CC1CCN(CC1)C(=O)CS(=O)CC2=C(C=C(C=C2)Br)F

DOS

IR

Vibrations