Geometry & MOs

Info

ID:	258812
PubChem CID:	103157103
Reduced:	NSO3C15H23 (1)
Stoich.:	ABC3D15E23 (1)
Weight, g/mol:	315.11567
ΔH_f, kcal/mol:	-134.69
Dipole, Da:	8.91
IP(EA), eV:	-8.82(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[1-(2,4-dichlorophenyl)ethylamino]propan-2-ol

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=C(C=C1)NCC(CC2CCCC2)O

DOS

IR

Vibrations