Geometry & MOs

Info

ID:	403695
PubChem CID:	135061375
Reduced:	ON3H11C14 (1)
Stoich.:	AB3C11D14 (1)
Weight, g/mol:	271.05124
ΔH_f, kcal/mol:	90.73
Dipole, Da:	2.87
IP(EA), eV:	-9.03(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzyl-2-chloro-3-nitroso-1H-pyrrolo[2,3-b]pyridine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CC2=CC3=C(NC=C3N=O)N=C2

DOS

IR

Vibrations