Geometry & MOs

Info

ID:	419707
PubChem CID:	135108727
Reduced:	NOC10H15 (2)
Stoich.:	ABC10D15 (2)
Weight, g/mol:	344.221226
ΔH_f, kcal/mol:	-89.76
Dipole, Da:	3.75
IP(EA), eV:	-9.11(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S,5R)-3-[(5-ethylpyridin-2-yl)methyl]-7-oxo-3,6-diazabicyclo[3.2.2]nonan-6-yl]-N,N-dimethylacetamide

Drug info:

PubChemData

Smile

CN1CCC[C@]2([C@H]1CN(CC2)C(=O)CCCC3=CC=CC=C3)CO

DOS

IR

Vibrations