Geometry & MOs

Info

ID:	69720
PubChem CID:	47205245
Reduced:	BrN3O3C13H14 (1)
Stoich.:	AB3C3D13E14 (1)
Weight, g/mol:	377.93436
ΔH_f, kcal/mol:	-51.6
Dipole, Da:	5.8
IP(EA), eV:	-9.36(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[2-(5-sulfamoylthiophen-2-yl)ethyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C(=C1)Br)OC)C(=O)NCC2=CC=NN2

DOS

IR

Vibrations