Geometry & MOs

Info

ID:	695
PubChem CID:	3212
Reduced:	H3O4C7 (2)
Stoich.:	A3B4C7 (2)
Weight, g/mol:	302.006267
ΔH_f, kcal/mol:	-214.32
Dipole, Da:	12.12
IP(EA), eV:	-8.38(-2.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,10,13,14-tetrahydroxy-2,9-dioxatetracyclo[6.6.2.04,16.011,15]hexadeca-1(14),4,7,10,12,15-hexaene-3,6-dione

Drug info:

PubChemData

Smile

C1=C2C3=C4C(=C(OC3=C(C1=O)O)O)C=C(C(=C4OC2=O)O)O

DOS

IR

Vibrations