Geometry & MOs

Info

ID:	55883
PubChem CID:	17396966
Reduced:	OSN3C16H17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	323.080299
ΔH_f, kcal/mol:	47.37
Dipole, Da:	4.94
IP(EA), eV:	-8.66(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,6-dimethyl-4-[4-(trifluoromethyl)phenyl]sulfonylmorpholine

Drug info:

PubChemData

Smile

CC1=C(C=CO1)C2=NN=C(N2C)SC(C)C3=CC=CC=C3

DOS

IR

Vibrations