Geometry & MOs

Info

ID:	369834
PubChem CID:	127336401
Reduced:	SN3O5C17H31 (1)
Stoich.:	AB3C5D17E31 (1)
Weight, g/mol:	371.187878
ΔH_f, kcal/mol:	-245.96
Dipole, Da:	5.5
IP(EA), eV:	-9.72(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(oxan-4-ylsulfonyl)piperidin-4-yl]-2-azabicyclo[2.2.1]heptane-2-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)CNC(=O)NC2CCN(CC2)S(=O)(=O)C3CCOCC3

DOS

IR

Vibrations