Geometry & MOs

Info

ID:	406640
PubChem CID:	135078241
Reduced:	IO2N3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	399.04437
ΔH_f, kcal/mol:	-34.47
Dipole, Da:	3.68
IP(EA), eV:	-8.97(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCN(CC1=CC=CC=C1I)C2=CN(C(=O)N(C2=O)C)C

DOS

IR

Vibrations