Geometry & MOs

Info

ID:	195073
PubChem CID:	78630053
Reduced:	SO2N5C22H25 (1)
Stoich.:	AB2C5D22E25 (1)
Weight, g/mol:	332.095654
ΔH_f, kcal/mol:	42.24
Dipole, Da:	7.44
IP(EA), eV:	-8.25(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

3-[(2-butan-2-ylphenyl)sulfamoyl]benzoate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)OCC2=NNC(=S)N2N=CC3=CC=C(C=C3)N4CCOCC4)C

DOS

IR

Vibrations