Geometry & MOs

Info

ID:	247683
PubChem CID:	103072663
Reduced:	ION3C12H18 (1)
Stoich.:	ABC3D12E18 (1)
Weight, g/mol:	215.046154
ΔH_f, kcal/mol:	-2.16
Dipole, Da:	2.6
IP(EA), eV:	-9.04(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(aminomethyl)prop-2-enyl]-5-chloropyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCCNCC(=C)CN1C=NC(=C(C1=O)I)C

DOS

IR

Vibrations