Geometry & MOs

Info

ID:	204403
PubChem CID:	79960187
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	287.199762
ΔH_f, kcal/mol:	17.27
Dipole, Da:	2.55
IP(EA), eV:	-8.76(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,4-diazabicyclo[2.2.2]octan-2-yl)-2-(3,4-dihydro-1H-isochromen-1-yl)ethanamine

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2N=C1CC(=O)C3CN4CCN3CC4

DOS

IR

Vibrations