Geometry & MOs

Info

ID:	69766
PubChem CID:	47205351
Reduced:	O3N4C13H16 (1)
Stoich.:	A3B4C13D16 (1)
Weight, g/mol:	333.000861
ΔH_f, kcal/mol:	-7.76
Dipole, Da:	10.68
IP(EA), eV:	-9.35(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)C1=CC(=C(C=C1)NC)[N+](=O)[O-])C#N

DOS

IR

Vibrations