Geometry & MOs

Info

ID:	203225
PubChem CID:	79795540
Reduced:	BrON3H10C13 (1)
Stoich.:	ABC3D10E13 (1)
Weight, g/mol:	251.105862
ΔH_f, kcal/mol:	31.62
Dipole, Da:	7.47
IP(EA), eV:	-8.57(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,3-dihydro-2-benzofuran-5-yl)-6-methyl-1H-imidazo[4,5-b]pyridine

Drug info:

PubChemData

Smile

CC1=CC2=C(N/C(=C/3\C=CC(=CC3=O)Br)/N2)N=C1

DOS

IR

Vibrations