Geometry & MOs

Info

ID:	257492
PubChem CID:	103146583
Reduced:	N2O2F3H13C14 (1)
Stoich.:	A2B2C3D13E14 (1)
Weight, g/mol:	264.108562
ΔH_f, kcal/mol:	-192.76
Dipole, Da:	7.44
IP(EA), eV:	-9.56(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-propyl-2-[2-(2,2,2-trifluoroethoxy)ethyl]-1H-pyrimidin-4-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=O)N=C(N2)CCOCC(F)(F)F

DOS

IR

Vibrations