Geometry & MOs

Info

ID:	147404
PubChem CID:	53787060
Reduced:	BrNOC13H16 (1)
Stoich.:	ABCD13E16 (1)
Weight, g/mol:	316.063011
ΔH_f, kcal/mol:	-30.01
Dipole, Da:	5.38
IP(EA), eV:	-9.57(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(2-oxo-1H-pyrrolo[3,2-c]pyridin-3-ylidene)methylamino]benzenesulfonamide

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)C(C2=CC=CC=C2)Br

DOS

IR

Vibrations