Geometry & MOs

Info

ID:	12837
PubChem CID:	146507
Reduced:	ClN2O2C11H13 (2)
Stoich.:	AB2C2D11E13 (2)
Weight, g/mol:	480.133111
ΔH_f, kcal/mol:	-72.37
Dipole, Da:	9.66
IP(EA), eV:	-7.64(-1.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(dimethylamino)-N-[4-[[2-(dimethylamino)acetyl]amino]-9,10-dioxoanthracen-1-yl]acetamide;dihydrochloride

Drug info:

PubChemData

Smile

CN(C)CC(=O)NC1=C2C(=C(C=C1)NC(=O)CN(C)C)C(=O)C3=CC=CC=C3C2=O.Cl.Cl

DOS

IR

Vibrations