Geometry & MOs

Info

ID:	271
PubChem CID:	2471
Reduced:	SN2O5C17H20 (1)
Stoich.:	AB2C5D17E20 (1)
Weight, g/mol:	364.109293
ΔH_f, kcal/mol:	-154.05
Dipole, Da:	8.55
IP(EA), eV:	-9.06(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(butylamino)-4-phenoxy-5-sulfamoylbenzoic acid

Drug info:

PubChemData

Smile

CCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

DOS

IR

Vibrations