Geometry & MOs

Info

ID:	56753
PubChem CID:	22389396
Reduced:	ON2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	398.99023
ΔH_f, kcal/mol:	-35.22
Dipole, Da:	7.31
IP(EA), eV:	-8.64(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC3=CC(=NC=C3O2)C(=O)NC4CC5CCN(C5)C4

DOS

IR

Vibrations