Geometry & MOs

Info

ID:	361323
PubChem CID:	127302518
Reduced:	OSN5C19H31 (1)
Stoich.:	ABC5D19E31 (1)
Weight, g/mol:	359.130363
ΔH_f, kcal/mol:	-23.07
Dipole, Da:	7.09
IP(EA), eV:	-8.44(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-hydroxy-N-[3-(1,3-thiazol-4-ylmethoxy)phenyl]-8-azabicyclo[3.2.1]octane-8-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)N2CCSCC2)NC(=O)NCC3CN(CCN3C)C

DOS

IR

Vibrations