Geometry & MOs

Info

ID:	361303
PubChem CID:	127302498
Reduced:	O3N4C20H30 (1)
Stoich.:	A3B4C20D30 (1)
Weight, g/mol:	365.140927
ΔH_f, kcal/mol:	-111.96
Dipole, Da:	2.96
IP(EA), eV:	-8.2(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1,1-dioxo-1,2-thiazolidin-2-yl)phenyl]-3-hydroxy-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)NC2=CC3=C(C=C2)OC4(O3)CCCCC4)C

DOS

IR

Vibrations