Geometry & MOs

Info

ID:	249685
PubChem CID:	103091358
Reduced:	SN2O5C11H16 (1)
Stoich.:	AB2C5D11E16 (1)
Weight, g/mol:	299.082744
ΔH_f, kcal/mol:	-191.76
Dipole, Da:	4.4
IP(EA), eV:	-9.92(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-methoxycyclopentyl)sulfamoyl]benzoic acid

Drug info:

PubChemData

Smile

COC1CCC(C1)NS(=O)(=O)C2=CNC(=C2)C(=O)O

DOS

IR

Vibrations