Geometry & MOs

Info

ID:	82554
PubChem CID:	49856173
Reduced:	NC9H10 (2)
Stoich.:	AB9C10 (2)
Weight, g/mol:	239.142248
ΔH_f, kcal/mol:	71.41
Dipole, Da:	1.66
IP(EA), eV:	-9.04(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,5S)-N-(quinolin-2-ylmethyl)-3-azabicyclo[3.1.0]hexan-6-amine

Drug info:

PubChemData

Smile

C1[C@@H]2[C@@H](C2NCC3=CC=C(C=C3)C4=CC=CC=C4)CN1

DOS

IR

Vibrations