Geometry & MOs

Info

ID:	362200
PubChem CID:	127307213
Reduced:	O3N4C18H26 (1)
Stoich.:	A3B4C18D26 (1)
Weight, g/mol:	352.156912
ΔH_f, kcal/mol:	-23.88
Dipole, Da:	4.69
IP(EA), eV:	-8.64(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2CC(CC1N2C(=O)NCC3=CN=C(C=C3)N4CCOCC4)O

DOS

IR

Vibrations