Geometry & MOs

Info

ID:	281773
PubChem CID:	103914345
Reduced:	NSO3C10H23 (1)
Stoich.:	ABC3D10E23 (1)
Weight, g/mol:	263.155515
ΔH_f, kcal/mol:	-165.68
Dipole, Da:	3.14
IP(EA), eV:	-9.17(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,3-dimethyl-4-[(2-methylsulfonylcyclopentyl)amino]butan-1-ol

Drug info:

PubChemData

Smile

CC(CS(=O)(=O)C)NCC(C)(C)CCO

DOS

IR

Vibrations