Geometry & MOs

Info

ID:	297660
PubChem CID:	117625115
Reduced:	SN3O9C37H43 (1)
Stoich.:	AB3C9D37E43 (1)
Weight, g/mol:	727.456037
ΔH_f, kcal/mol:	-278.23
Dipole, Da:	14.61
IP(EA), eV:	-6.77(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-methoxycarbonyl-2,6-dimethylphenyl) 2,7-bis[8-(dimethylamino)octoxy]acridine-9-carboxylate

Drug info:

PubChemData

Smile

CCCC[N+](C)(C)CC1=CC2=C(C3=CC=CC=C3[N+](=C2C=C1)CCCS(=O)(=O)O)C(=O)OC4=C(C=C(C=C4C)C(=O)ON5C(=O)CCC5=O)C

DOS

IR

Vibrations