Geometry & MOs

Info

ID:	290449
PubChem CID:	104548465
Reduced:	SO2N3C15H19 (1)
Stoich.:	AB2C3D15E19 (1)
Weight, g/mol:	268.195092
ΔH_f, kcal/mol:	3.89
Dipole, Da:	1.3
IP(EA), eV:	-8.85(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-fluoro-N-methyl-2-[(2-methylpropylamino)methyl]anilino]propan-1-ol

Drug info:

PubChemData

Smile

CNCCC1=CC=CC=C1C2=NC(=NO2)C3CSCCO3

DOS

IR

Vibrations