Geometry & MOs

Info

ID:	267867
PubChem CID:	103589931
Reduced:	FN2C13H21 (1)
Stoich.:	AB2C13D21 (1)
Weight, g/mol:	212.132491
ΔH_f, kcal/mol:	-54.28
Dipole, Da:	2.8
IP(EA), eV:	-8.22(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-amino-4-fluoro-5-methylanilino)butan-1-ol

Drug info:

PubChemData

Smile

CCC(C)CN(C)C1=C(C=C(C(=C1)C)F)N

DOS

IR

Vibrations