Geometry & MOs

Info

ID:	258908
PubChem CID:	103157397
Reduced:	NO2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	263.155515
ΔH_f, kcal/mol:	-198.65
Dipole, Da:	8.72
IP(EA), eV:	-9.75(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(3-methylsulfonylpropylamino)propan-2-ol

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)C1CCCCCN1

DOS

IR

Vibrations