Geometry & MOs

Info

ID:	13447
PubChem CID:	232834
Reduced:	SO2N4C5H6 (1)
Stoich.:	AB2C4D5E6 (1)
Weight, g/mol:	186.021147
ΔH_f, kcal/mol:	-47.38
Dipole, Da:	9.93
IP(EA), eV:	-9.76(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-oxo-2-sulfanyl-1H-pyrimidin-6-yl)urea

Drug info:

PubChemData

Smile

C1=C(NC(=NC1=O)S)NC(=O)N

DOS

IR

Vibrations