Geometry & MOs

Info

ID:	362204
PubChem CID:	127307217
Reduced:	SO2N4C17H26 (1)
Stoich.:	AB2C4D17E26 (1)
Weight, g/mol:	364.193297
ΔH_f, kcal/mol:	-70.78
Dipole, Da:	2.33
IP(EA), eV:	-8.66(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[4-[(3-methylpiperidin-1-yl)methyl]-1,3-thiazol-2-yl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2=CSC(=N2)NC(=O)N3C4CCC3CC(C4)O

DOS

IR

Vibrations