Geometry & MOs

Info

ID:	9482
PubChem CID:	89912
Reduced:	SN2O5C7H14 (1)
Stoich.:	AB2C5D7E14 (1)
Weight, g/mol:	238.062343
ΔH_f, kcal/mol:	-208.83
Dipole, Da:	4.93
IP(EA), eV:	-9.01(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sulfuric acid;1,3,4-trimethyl-4H-pyrimidin-2-one

Drug info:

PubChemData

Smile

CC1C=CN(C(=O)N1C)C.OS(=O)(=O)O

DOS

IR

Vibrations