Geometry & MOs

Info

ID:	18402
PubChem CID:	540390
Reduced:	SN3O3C6H7 (1)
Stoich.:	AB3C3D6E7 (1)
Weight, g/mol:	201.020812
ΔH_f, kcal/mol:	-108.55
Dipole, Da:	2.32
IP(EA), eV:	-9.06(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-6-oxo-2-sulfanyl-1H-pyrimidin-5-yl)acetamide

Drug info:

PubChemData

Smile

CC(=O)NC1=C(N=C(NC1=O)S)O

DOS

IR

Vibrations