Geometry & MOs

Info

ID:	431235
PubChem CID:	135171305
Reduced:	O3N5C20H27 (1)
Stoich.:	A3B5C20D27 (1)
Weight, g/mol:	265.91884
ΔH_f, kcal/mol:	-50.34
Dipole, Da:	3.41
IP(EA), eV:	-8.62(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,4-dioxo-1H-pyrimidine-5-carbonyl iodide

Drug info:

PubChemData

Smile

CC1=C(N=CN=C1N2CCOCC2)N3CCC(CC3)OC4=CN=C(C=C4)OC

DOS

IR

Vibrations