Geometry & MOs

Info

ID:	56751
PubChem CID:	22389368
Reduced:	BrO2N3C14H14 (1)
Stoich.:	AB2C3D14E14 (1)
Weight, g/mol:	383.01307
ΔH_f, kcal/mol:	-5.83
Dipole, Da:	4.37
IP(EA), eV:	-9.28(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[2.2.1]heptan-3-yl)-3-iodofuro[2,3-c]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

C1C2CC(C1CN2)NC(=O)C3=NC=C4C=C(OC4=C3)Br

DOS

IR

Vibrations