Geometry & MOs

Info

ID:	56723
PubChem CID:	22389050
Reduced:	OSN3C14H15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	372.161997
ΔH_f, kcal/mol:	18.99
Dipole, Da:	6.08
IP(EA), eV:	-9.25(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1C2CC(C1CN2)NC(=O)C3=CC4=C(S3)C=CC=N4

DOS

IR

Vibrations