Geometry & MOs

Info

ID:	181795
PubChem CID:	76793251
Reduced:	NO2C27H41 (1)
Stoich.:	AB2C27D41 (1)
Weight, g/mol:	541.278801
ΔH_f, kcal/mol:	-113.49
Dipole, Da:	2.24
IP(EA), eV:	-9.86(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,7-bis(dimethylamino)-1,10,11,12a-tetrahydroxy-9-(4-methylpentyl)-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCC=CC(CC)N1C(=O)C2=CC=CC=C2C1=O

DOS

IR

Vibrations