Geometry & MOs

Info

ID:	59981
PubChem CID:	26527399
Reduced:	SN3O4C11H19 (1)
Stoich.:	AB3C4D11E19 (1)
Weight, g/mol:	392.151826
ΔH_f, kcal/mol:	-181.94
Dipole, Da:	4.33
IP(EA), eV:	-9.74(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-1,3-dimethylpyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CCC(C)(C)NS(=O)(=O)C1=CN(C(=O)N(C1=O)C)C

DOS

IR

Vibrations