Geometry & MOs

Info

ID:	136069
PubChem CID:	51974292
Reduced:	N4C25H26 (1)
Stoich.:	A4B25C26 (1)
Weight, g/mol:	383.223572
ΔH_f, kcal/mol:	69.79
Dipole, Da:	2.96
IP(EA), eV:	-7.87(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(6R)-2,3-dimethyl-6-phenyl-1-(pyridin-2-ylmethyl)-5,6,7,8-tetrahydropyrrolo[2,3-b]quinolin-9-ium-4-amine

Drug info:

PubChemData

Smile

CC1=C(N(C2=NC3=C(C[C@H](CC3)C4=CC=CC=C4)C(=C12)N)CC5=CC=CC=N5)C

DOS

IR

Vibrations