Geometry & MOs

Info

ID:	56729
PubChem CID:	22389097
Reduced:	O2N4C17H20 (1)
Stoich.:	A2B4C17D20 (1)
Weight, g/mol:	330.151433
ΔH_f, kcal/mol:	9.7
Dipole, Da:	3.67
IP(EA), eV:	-8.8(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[3.2.1]octan-3-yl)-2-(dimethylamino)thieno[3,2-c]pyridine-6-carboxamide

Drug info:

PubChemData

Smile

C1CC1NC2=COC3=CN=C(C=C32)C(=O)NC4CN5CCC4C5

DOS

IR

Vibrations