Geometry & MOs

Info

ID:	56744
PubChem CID:	22389314
Reduced:	ON2C9H11 (2)
Stoich.:	AB2C9D11 (2)
Weight, g/mol:	369.216475
ΔH_f, kcal/mol:	-6.22
Dipole, Da:	2.44
IP(EA), eV:	-8.76(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-azabicyclo[3.2.1]octan-3-yl)-3-(4-methylpiperazin-1-yl)furo[2,3-c]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

C1CC1NC2=COC3=CN=C(C=C32)C(=O)NC4CC5CCN(C5)C4

DOS

IR

Vibrations