Geometry & MOs

Info

ID:	289460
PubChem CID:	104355550
Reduced:	SN2O4C14H22 (1)
Stoich.:	AB2C4D14E22 (1)
Weight, g/mol:	302.093643
ΔH_f, kcal/mol:	-174.13
Dipole, Da:	7.23
IP(EA), eV:	-9.46(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-[3-methoxypropyl(methyl)sulfamoyl]benzoic acid

Drug info:

PubChemData

Smile

CCCCCC(C)NS(=O)(=O)C1=C(C=C(C=C1)N)C(=O)O

DOS

IR

Vibrations