Geometry & MOs

Info

ID:	261608
PubChem CID:	103241965
Reduced:	BrFNO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	286.152872
ΔH_f, kcal/mol:	-160.73
Dipole, Da:	5.79
IP(EA), eV:	-9.34(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

C1CC(OC1CNCC2=C(C=CC(=C2)F)Br)C(=O)O

DOS

IR

Vibrations