Geometry & MOs

Info

ID:	403777
PubChem CID:	135061792
Reduced:	SO2N3C12H17 (1)
Stoich.:	AB2C3D12E17 (1)
Weight, g/mol:	473.140927
ΔH_f, kcal/mol:	-51.78
Dipole, Da:	4.24
IP(EA), eV:	-9.37(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 2-[1-(benzenesulfonyl)pyrrolo[3,2-b]pyridin-5-yl]indole-1-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CNC2=NC=CC(=C12)C

DOS

IR

Vibrations