Geometry & MOs

Info

ID:	170292
PubChem CID:	75214674
Reduced:	NO7H23C28 (1)
Stoich.:	AB7C23D28 (1)
Weight, g/mol:	563.28964
ΔH_f, kcal/mol:	-199.91
Dipole, Da:	7.49
IP(EA), eV:	-9.05(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-benzyl-3-[4-[3-(2-methylimidazo[4,5-b]pyridin-3-yl)-8-azabicyclo[3.2.1]octan-8-yl]-2-phenylbutanoyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C2C(C1=O)(C3=C(O2)C(=C(C=C3O)OC)C(=O)NCC4=CC5=CC=CC=C5C=C4)C)O

DOS

IR

Vibrations