Geometry & MOs

Info

ID:	286554
PubChem CID:	104171039
Reduced:	NSO3C7H17 (1)
Stoich.:	ABC3D7E17 (1)
Weight, g/mol:	227.098
ΔH_f, kcal/mol:	-141.19
Dipole, Da:	4.68
IP(EA), eV:	-9.78(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxypropylsulfinyl)-6-methylaniline

Drug info:

PubChemData

Smile

CC(CN)S(=O)(=O)CC(C)OC

DOS

IR

Vibrations