Geometry & MOs

Info

ID:	287623
PubChem CID:	104249102
Reduced:	NOC6H10 (2)
Stoich.:	ABC6D10 (2)
Weight, g/mol:	226.131742
ΔH_f, kcal/mol:	-92.88
Dipole, Da:	9.69
IP(EA), eV:	-9.3(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-hydroxy-2-(2-methoxypropyl)-5-propyl-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CC(CC1=NC(=O)C=C(N1)C(C)(C)C)OC

DOS

IR

Vibrations