Geometry & MOs

Info

ID:	257481
PubChem CID:	103146504
Reduced:	F2N2O4C13H18 (1)
Stoich.:	A2B2C4D13E18 (1)
Weight, g/mol:	219.081933
ΔH_f, kcal/mol:	-230.92
Dipole, Da:	6.23
IP(EA), eV:	-10.54(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-amino-2-[2-(2,2-difluoroethoxy)ethyl]-1H-pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1CC(C(C1)C(=O)O)C2=NC(=NO2)CCOCC(F)F

DOS

IR

Vibrations