Geometry & MOs

Info

ID:	155240
PubChem CID:	56323424
Reduced:	SN3O4H19C21 (1)
Stoich.:	AB3C4D19E21 (1)
Weight, g/mol:	417.045313
ΔH_f, kcal/mol:	-60.6
Dipole, Da:	10.47
IP(EA), eV:	-8.64(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-5-[[3-(pyridin-4-ylcarbamoyl)phenyl]sulfamoyl]thiophene-2-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C=C/S(=O)(=O)NC2=CN=C(C=C2)OC3=CC=CC(=C3)C(=O)N

DOS

IR

Vibrations