Geometry & MOs

Info

ID:	185812
PubChem CID:	77351453
Reduced:	O4C23H36 (1)
Stoich.:	A4B23C36 (1)
Weight, g/mol:	619.25298
ΔH_f, kcal/mol:	-202.41
Dipole, Da:	4.84
IP(EA), eV:	-9.15(0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(dimethylamino)-9-[2-(dimethylamino)-3-(4-methoxyphenyl)propanoyl]-1,10,11,12a-tetrahydroxy-3,12-dioxo-4a,5,5a,6-tetrahydro-4H-tetracene-2-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(CC1)CC=C(C2C(CC3C2CC(=C3)CCCCC(=O)O)O)O

DOS

IR

Vibrations