Geometry & MOs

Info

ID:	149788
PubChem CID:	53789464
Reduced:	N2O3H10C16 (1)
Stoich.:	A2B3C10D16 (1)
Weight, g/mol:	273.921798
ΔH_f, kcal/mol:	24.48
Dipole, Da:	3.08
IP(EA), eV:	-9.78(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(dichloromethylsulfonyl)-6-hydroxy-1H-pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)OC(=O)C(C#N)C2=NOC3=CC=CC=C32

DOS

IR

Vibrations