Geometry & MOs

Info

ID:	206425
PubChem CID:	80249518
Reduced:	NSO2C6H9 (2)
Stoich.:	ABC2D6E9 (2)
Weight, g/mol:	301.007865
ΔH_f, kcal/mol:	-150.43
Dipole, Da:	4.38
IP(EA), eV:	-9.15(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(4-methylthiophen-3-yl)methylsulfamoyl]furan-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CSC=C1CNS(=O)(=O)N2CCCCC2C(=O)O

DOS

IR

Vibrations