Geometry & MOs

Info

ID:	369399
PubChem CID:	127333119
Reduced:	N2O3C21H30 (1)
Stoich.:	A2B3C21D30 (1)
Weight, g/mol:	342.140199
ΔH_f, kcal/mol:	-127.04
Dipole, Da:	4.14
IP(EA), eV:	-9.05(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-benzyl-1,3-thiazol-4-yl)-1-(3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl)ethanone

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2=CC=C(C=C2)C(=O)N3C4CCC3CC(C4)O

DOS

IR

Vibrations