Geometry & MOs

Info

ID:	12810
PubChem CID:	145852
Reduced:	O2N4C19H22 (1)
Stoich.:	A2B4C19D22 (1)
Weight, g/mol:	338.174276
ΔH_f, kcal/mol:	59.31
Dipole, Da:	8.61
IP(EA), eV:	-8.64(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N',N'-dimethyl-N-(4-nitroacridin-9-yl)butane-1,4-diamine

Drug info:

PubChemData

Smile

CN(C)CCCCNC1=C2C=CC=C(C2=NC3=CC=CC=C31)[N+](=O)[O-]

DOS

IR

Vibrations