Geometry & MOs

Info

ID:	279625
PubChem CID:	103844494
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	272.10823
ΔH_f, kcal/mol:	-38.99
Dipole, Da:	4.73
IP(EA), eV:	-8.74(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(3-ethylsulfonylpropoxy)phenyl]ethanol

Drug info:

PubChemData

Smile

C1CCC(C1)N2C=CC(=N2)COC3=CC=C(C=C3)CCO

DOS

IR

Vibrations