Geometry & MOs

Info

ID:	162051
PubChem CID:	57393448
Reduced:	NO2C15H21 (1)
Stoich.:	AB2C15D21 (1)
Weight, g/mol:	578.358054
ΔH_f, kcal/mol:	-76.24
Dipole, Da:	3.4
IP(EA), eV:	-9.01(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-(dimethylamino)butylamino]-N-[8-[3-[4-(dimethylamino)butylamino]propanoylamino]-9,10-dioxoanthracen-1-yl]propanamide

Drug info:

PubChemData

Smile

CN1[C@H]([C@]2(CCCC1C2)C3=CC(=CC=C3)O)CO

DOS

IR

Vibrations