Geometry & MOs

Info

ID:	68535
PubChem CID:	46508604
Reduced:	Cl2N2O4C19H20 (1)
Stoich.:	A2B2C4D19E20 (1)
Weight, g/mol:	442.152872
ΔH_f, kcal/mol:	-132.14
Dipole, Da:	4.81
IP(EA), eV:	-8.65(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-N-(9,10-dioxoanthracen-1-yl)acetamide

Drug info:

PubChemData

Smile

CN(CC(=O)NC1=C(C=CC(=C1)Cl)OC)C(C2=CC=CC=C2Cl)C(=O)OC

DOS

IR

Vibrations