Geometry & MOs

Info

ID:	406642
PubChem CID:	135078243
Reduced:	IO2N3C16H20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	399.04437
ΔH_f, kcal/mol:	-43.29
Dipole, Da:	4.25
IP(EA), eV:	-8.98(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-5-[(2-iodophenyl)methyl-methylamino]-1-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCN1C=C(C(=O)N(C1=O)C)N(CC)CC2=CC=CC=C2I

DOS

IR

Vibrations