Geometry & MOs

Info

ID:	130779
PubChem CID:	51106052
Reduced:	O2N5H15C17 (1)
Stoich.:	A2B5C15D17 (1)
Weight, g/mol:	349.073242
ΔH_f, kcal/mol:	53.45
Dipole, Da:	4.84
IP(EA), eV:	-9.24(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[3-(cyclopropanecarbonylamino)phenyl]sulfamoyl]-1H-pyrrole-2-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN(N=N2)CCCN3C4=CC=CC=C4OC3=O

DOS

IR

Vibrations