Geometry & MOs

Info

ID:	15853
PubChem CID:	453694
Reduced:	ClSN2O4C14H15 (1)
Stoich.:	ABC2D4E14F15 (1)
Weight, g/mol:	342.044106
ΔH_f, kcal/mol:	-149.92
Dipole, Da:	4.09
IP(EA), eV:	-9.24(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2-chlorophenyl)sulfanyl-1-(2-hydroxyethoxymethyl)-5-methylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=C(N(C(=O)NC1=O)COCCO)SC2=CC=CC=C2Cl

DOS

IR

Vibrations