Geometry & MOs

Info

ID:	41087
PubChem CID:	8145226
Reduced:	O3N4C24H30 (1)
Stoich.:	A3B4C24D30 (1)
Weight, g/mol:	368.212673
ΔH_f, kcal/mol:	-76.37
Dipole, Da:	3.67
IP(EA), eV:	-8.34(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2S)-1-benzyl-5-methyl-2-phenyl-1,2,3,6-tetrahydropyridin-1-ium-4-yl]-phenyldiazene

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1N2CCN(CC2)CN3C(=O)[C@@H](N(C3=O)C4=CC=C(C=C4)C)C

DOS

IR

Vibrations