Geometry & MOs

Info

ID:	293633
PubChem CID:	117394660
Reduced:	SN2O2C12H20 (1)
Stoich.:	AB2C2D12E20 (1)
Weight, g/mol:	256.113316
ΔH_f, kcal/mol:	-83.23
Dipole, Da:	3.25
IP(EA), eV:	-8.81(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,6-dimethoxy-2-methylsulfanylphenyl)-2-methylpropan-1-ol

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations