Geometry & MOs

Info

ID:	288461
PubChem CID:	104316964
Reduced:	FNO2C12H18 (1)
Stoich.:	ABC2D12E18 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-131.11
Dipole, Da:	1.38
IP(EA), eV:	-8.79(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[N-(3-aminopropyl)-2-methylanilino]butan-2-ol

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)OCCC(C)O)F)N

DOS

IR

Vibrations