Geometry & MOs

Info

ID:	3780
PubChem CID:	10169
Reduced:	O7H8C15 (1)
Stoich.:	A7B8C15 (1)
Weight, g/mol:	300.027003
ΔH_f, kcal/mol:	-228.75
Dipole, Da:	4.67
IP(EA), eV:	-9.87(-2.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,5,7-trihydroxy-9,10-dioxoanthracene-1-carboxylic acid

Drug info:

PubChemData

Smile

C1=CC(=C2C(=C1C(=O)O)C(=O)C3=C(C2=O)C(=CC(=C3)O)O)O

DOS

IR

Vibrations