Geometry & MOs

Info

ID:	270212
PubChem CID:	103634880
Reduced:	FN4C13H19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	291.138305
ΔH_f, kcal/mol:	-21.74
Dipole, Da:	3.48
IP(EA), eV:	-8.76(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(3,4-dimethoxyphenyl)ethyl]-5-fluoro-6-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1=C(C(=NC=N1)NC2CCN3CCCC3C2)F

DOS

IR

Vibrations