Geometry & MOs

Info

ID:	13482
PubChem CID:	236634
Reduced:	ClO2N3C8H12 (1)
Stoich.:	AB2C3D8E12 (1)
Weight, g/mol:	217.061804
ΔH_f, kcal/mol:	-90.7
Dipole, Da:	3.92
IP(EA), eV:	-9.54(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-chloroethyl(ethyl)amino]-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCN(CCCl)C1=CNC(=O)NC1=O

DOS

IR

Vibrations