Geometry & MOs

Info

ID:	420680
PubChem CID:	135114656
Reduced:	N2O3C25H30 (1)
Stoich.:	A2B3C25D30 (1)
Weight, g/mol:	348.204907
ΔH_f, kcal/mol:	-90.27
Dipole, Da:	6.9
IP(EA), eV:	-8.52(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2-ethoxyethoxy)phenyl]-[(1S,5R)-9-methyl-3-oxa-7,9-diazabicyclo[3.3.2]decan-7-yl]methanone

Drug info:

PubChemData

Smile

COC1=CC=CC2=C1C3(CCN(CC3)C(=O)CN4CCC5=CC=CC=C5C4)OCC2

DOS

IR

Vibrations