Geometry & MOs

Info

ID:	381495
PubChem CID:	134972252
Reduced:	O4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	368.125988
ΔH_f, kcal/mol:	-138.09
Dipole, Da:	3.67
IP(EA), eV:	-10.23(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-hydroxy-1-(3-methylbutyl)-9,10-dioxoanthracen-2-yl]oxyacetic acid

Drug info:

PubChemData

Smile

CC(C)CC[C@]12C=CC(=O)C=C1OCC(=O)O2

DOS

IR

Vibrations