Geometry & MOs

Info

ID:	201427
PubChem CID:	79539459
Reduced:	ClNSO3C15H18 (1)
Stoich.:	ABCD3E15F18 (1)
Weight, g/mol:	288.183778
ΔH_f, kcal/mol:	-111.03
Dipole, Da:	3.12
IP(EA), eV:	-9.56(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-piperidin-2-ylcyclopentyl)-1,3-benzodioxol-5-amine

Drug info:

PubChemData

Smile

C1CC(C(=O)C1)C2CCCN2S(=O)(=O)C3=CC=CC=C3Cl

DOS

IR

Vibrations