Geometry & MOs

Info

ID:	263975
PubChem CID:	103411723
Reduced:	ClN2O3C11H17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	276.087685
ΔH_f, kcal/mol:	-119.34
Dipole, Da:	4.01
IP(EA), eV:	-9.83(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-5-methoxy-3-[3-(2-methoxyethoxy)propyl]pyrimidin-4-one

Drug info:

PubChemData

Smile

CC1=NC(=CC(=O)N1CCCOCCOC)Cl

DOS

IR

Vibrations