Geometry & MOs

Info

ID:	191670
PubChem CID:	78174984
Reduced:	NO2C19H21 (1)
Stoich.:	AB2C19D21 (1)
Weight, g/mol:	221.116427
ΔH_f, kcal/mol:	-57.23
Dipole, Da:	3.56
IP(EA), eV:	-9.61(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-(piperidin-1-ylmethyl)pyrimidine-4,5-dione

Drug info:

PubChemData

Smile

C1CC(NC(=O)C1)CC(C2=CC=CC=C2)(C3=CC=CC=C3)O

DOS

IR

Vibrations