Geometry & MOs

Info

ID:	48222
PubChem CID:	10538104
Reduced:	O3H14C15 (1)
Stoich.:	A3B14C15 (1)
Weight, g/mol:	242.126657
ΔH_f, kcal/mol:	-31.57
Dipole, Da:	3.67
IP(EA), eV:	-8.64(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-4-methoxy-1-(2-methoxyethoxymethyl)pyrimidin-2-one

Drug info:

PubChemData

Smile

CC1C=CCC2C1C(=O)C3=C(C2=O)C=CC=C3O

DOS

IR

Vibrations