Geometry & MOs

Info

ID:	156922
PubChem CID:	56394871
Reduced:	SO3N4H18C19 (1)
Stoich.:	AB3C4D18E19 (1)
Weight, g/mol:	431.122969
ΔH_f, kcal/mol:	-43.55
Dipole, Da:	9.31
IP(EA), eV:	-8.83(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-[[2-(5-nitroindol-1-yl)acetyl]amino]pyridin-2-yl]oxybenzamide

Drug info:

PubChemData

Smile

CCC1=NC(=C(S1)C(=O)NC2=CN=C(C=C2)OC3=CC=CC(=C3)C(=O)N)C

DOS

IR

Vibrations