Geometry & MOs

Info

ID:	336504
PubChem CID:	127255511
Reduced:	N3O4C12H17 (1)
Stoich.:	A3B4C12D17 (1)
Weight, g/mol:	251.93957
ΔH_f, kcal/mol:	-141.77
Dipole, Da:	8.38
IP(EA), eV:	-9.07(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-iodo-3-methyl-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCOC(=O)C(=CNC1=NNC(=C1)C)C(=O)OCC

DOS

IR

Vibrations