Geometry & MOs

Info

ID:	274172
PubChem CID:	103807506
Reduced:	O2N3C11H15 (1)
Stoich.:	A2B3C11D15 (1)
Weight, g/mol:	242.163043
ΔH_f, kcal/mol:	-69.22
Dipole, Da:	5.62
IP(EA), eV:	-9.19(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,9-diazabicyclo[4.2.1]nonan-3-yl)-2-(2-methoxyethoxy)ethanone

Drug info:

PubChemData

Smile

C1CC(N(C1)C(=O)C2=CC(=O)NC=C2)CN

DOS

IR

Vibrations