Geometry & MOs

Info

ID:	1959
PubChem CID:	5424
Reduced:	H2C3O3 (2)
Stoich.:	A2B3C3 (2)
Weight, g/mol:	172.000788
ΔH_f, kcal/mol:	-183.81
Dipole, Da:	1.82
IP(EA), eV:	-9.68(-2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3,5,6-tetrahydroxycyclohexa-2,5-diene-1,4-dione

Drug info:

PubChemData

Smile

C1(=C(C(=O)C(=C(C1=O)O)O)O)O

DOS

IR

Vibrations