Geometry & MOs

Info

ID:	56745
PubChem CID:	22389327
Reduced:	O2N5C20H27 (1)
Stoich.:	A2B5C20D27 (1)
Weight, g/mol:	328.153541
ΔH_f, kcal/mol:	-19.62
Dipole, Da:	2.38
IP(EA), eV:	-8.54(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=COC3=CN=C(C=C32)C(=O)NC4CC5CCN(C5)C4

DOS

IR

Vibrations