Geometry & MOs

Info

ID:	297167
PubChem CID:	117611379
Reduced:	N4O4H26C27 (1)
Stoich.:	A4B4C26D27 (1)
Weight, g/mol:	438.168335
ΔH_f, kcal/mol:	-71.81
Dipole, Da:	10.2
IP(EA), eV:	-8.28(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-[3-[(6-chloro-2-methoxyacridin-9-yl)amino]propyl]-4-N-methyl-1,3,5-triazine-2,4,6-triamine

Drug info:

PubChemData

Smile

CC1CN(C2=C(O1)C=CC(=C2)NC(=O)C3=CC4=C(C=C3)C=C5N4C6(CCC6)CNC5=O)C(=O)C=C

DOS

IR

Vibrations