Geometry & MOs

Info

ID:	284773
PubChem CID:	104070001
Reduced:	NOF2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	259.168462
ΔH_f, kcal/mol:	-109.39
Dipole, Da:	4.4
IP(EA), eV:	-8.54(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-[1-(1-methylimidazol-2-yl)ethylamino]phenyl]propan-1-ol

Drug info:

PubChemData

Smile

CC(C1=C(C(=CC=C1)F)F)NC2=CC=CC(=C2)CCCO

DOS

IR

Vibrations