Geometry & MOs

Info

ID:	292576
PubChem CID:	117355884
Reduced:	NSO2C12H19 (1)
Stoich.:	ABC2D12E19 (1)
Weight, g/mol:	241.11365
ΔH_f, kcal/mol:	-91.38
Dipole, Da:	6.54
IP(EA), eV:	-9.4(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[4-(methylsulfonylmethyl)phenyl]propan-2-amine

Drug info:

PubChemData

Smile

CC(C)(CC1=CC(=CC=C1)CS(=O)(=O)C)N

DOS

IR

Vibrations