Geometry & MOs

Info

ID:	59980
PubChem CID:	26527396
Reduced:	NSO4C13H19 (1)
Stoich.:	ABC4D13E19 (1)
Weight, g/mol:	289.109627
ΔH_f, kcal/mol:	-162.09
Dipole, Da:	4.04
IP(EA), eV:	-10.06(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-N-(2-methylbutan-2-yl)-2,4-dioxopyrimidine-5-sulfonamide

Drug info:

PubChemData

Smile

CCC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C(=O)OC

DOS

IR

Vibrations