Geometry & MOs

Info

ID:	435543
PubChem CID:	135191775
Reduced:	F2O4N8C33H34 (1)
Stoich.:	A2B4C8D33E34 (1)
Weight, g/mol:	342.999382
ΔH_f, kcal/mol:	-114.42
Dipole, Da:	5.43
IP(EA), eV:	-8.5(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-N-(2,5-difluorophenyl)-1H-pyrrolo[2,3-b]pyridine-3-sulfonamide

Drug info:

PubChemData

Smile

C1CN(CCC1CN2CCOCC2)C(=O)CN3C=C(C(=N3)C4=CC5=CC=CC=C5C=C4OC(F)F)NC(=O)C6=C7N=CC=CN7N=C6

DOS

IR

Vibrations