Geometry & MOs

Info

ID:	46941
PubChem CID:	10528551
Reduced:	O2N5H25C29 (1)
Stoich.:	A2B5C25D29 (1)
Weight, g/mol:	475.294725
ΔH_f, kcal/mol:	83.54
Dipole, Da:	2.94
IP(EA), eV:	-8.42(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-oxo-N-(2-piperidin-1-ylethyl)-1-(2-piperidin-1-ylethylamino)-10H-acridine-4-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)N2[C@H]([C@@H](N(C2=O)CC3=CC=CC=C3)N4C5=CC=CC=C5N=N4)C6=CC=CC=C6

DOS

IR

Vibrations