Geometry & MOs

Info

ID:	56062
PubChem CID:	17404129
Reduced:	NO4H13C19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	353.06009
ΔH_f, kcal/mol:	-55.89
Dipole, Da:	6.39
IP(EA), eV:	-9.32(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-chlorophenyl)-2-(6-hydroxy-4-oxo-1-propylpyrimidin-2-yl)sulfanylacetamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NC(=CO2)COC3=CC4=C(C=C3)C=CC(=O)O4

DOS

IR

Vibrations