Geometry & MOs

Info

ID:	201614
PubChem CID:	79562482
Reduced:	SF2N2O3C13H18 (1)
Stoich.:	AB2C2D3E13F18 (1)
Weight, g/mol:	313.171165
ΔH_f, kcal/mol:	-202.75
Dipole, Da:	5.93
IP(EA), eV:	-9.43(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methyl-2-methylsulfonylpropyl)amino]-1-(4-propan-2-ylphenyl)ethanol

Drug info:

PubChemData

Smile

CC(C)(CNCC(=O)NC1=C(C=CC=C1F)F)S(=O)(=O)C

DOS

IR

Vibrations