Geometry & MOs

Info

ID:	283603
PubChem CID:	103992454
Reduced:	SN2O2C11H20 (1)
Stoich.:	AB2C2D11E20 (1)
Weight, g/mol:	261.093185
ΔH_f, kcal/mol:	-72.2
Dipole, Da:	5.02
IP(EA), eV:	-9.15(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[(2-chloro-4-fluorophenyl)methylamino]propoxy]ethanol

Drug info:

PubChemData

Smile

CCC1=NC=C(S1)CNCCCOCCO

DOS

IR

Vibrations