Geometry & MOs

Info

ID:	281463
PubChem CID:	103913910
Reduced:	NSO3C13H19 (1)
Stoich.:	ABC3D13E19 (1)
Weight, g/mol:	283.124215
ΔH_f, kcal/mol:	-117.75
Dipole, Da:	5.49
IP(EA), eV:	-9.6(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[[(2-methylsulfonylcyclopentyl)amino]methyl]phenyl]methanol

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NCC2=CC(=CC=C2)CO

DOS

IR

Vibrations