Geometry & MOs

Info

ID:	313833
PubChem CID:	126618197
Reduced:	ClSN3O4H14C16 (1)
Stoich.:	ABC3D4E14F16 (1)
Weight, g/mol:	395.093977
ΔH_f, kcal/mol:	-61.61
Dipole, Da:	3.0
IP(EA), eV:	-9.13(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-hydroxy-3-(1-naphthalen-1-ylsulfonyl-2,3-dihydropyrrolo[2,3-b]pyridin-5-yl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CN(C2=C1C=C(C=N2)/C=C/C(=O)NO)S(=O)(=O)C3=CC(=CC=C3)Cl

DOS

IR

Vibrations