Geometry & MOs

Info

ID:	258046
PubChem CID:	103150360
Reduced:	OF3N3C12H18 (1)
Stoich.:	AB3C3D12E18 (1)
Weight, g/mol:	235.093247
ΔH_f, kcal/mol:	-190.37
Dipole, Da:	6.88
IP(EA), eV:	-9.02(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,2-difluoroethoxy)ethyl]-5-fluoro-6-methylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCC1=C(C(=NC(=N1)CCOCC(F)(F)F)NC)C

DOS

IR

Vibrations