Geometry & MOs

Info

ID:	249688
PubChem CID:	103091371
Reduced:	NS2O5C11H15 (1)
Stoich.:	AB2C5D11E15 (1)
Weight, g/mol:	316.109293
ΔH_f, kcal/mol:	-180.36
Dipole, Da:	4.76
IP(EA), eV:	-9.96(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-4-[(3-methoxycyclopentyl)sulfamoyl]pyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

COC1CCC(C1)NS(=O)(=O)C2=CC(=CS2)C(=O)O

DOS

IR

Vibrations