Geometry & MOs

Info

ID:	256915
PubChem CID:	103142370
Reduced:	ON2C7H8 (2)
Stoich.:	AB2C7D8 (2)
Weight, g/mol:	284.225249
ΔH_f, kcal/mol:	42.76
Dipole, Da:	7.63
IP(EA), eV:	-9.03(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1,2,3,4-tetrahydroisoquinolin-8-yl)-3-azaspiro[5.5]undecane

Drug info:

PubChemData

Smile

C[C@H]1CN(CCN1)C2=C3C=NC=CC3=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations