Geometry & MOs

Info

ID:	3784
PubChem CID:	10183
Reduced:	O4H6C7 (2)
Stoich.:	A4B6C7 (2)
Weight, g/mol:	308.053217
ΔH_f, kcal/mol:	-303.85
Dipole, Da:	5.52
IP(EA), eV:	-9.19(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,8,10-trihydroxy-3-methyl-7-oxo-1,4-dihydropyrano[4,3-b]chromene-9-carboxylic acid

Drug info:

PubChemData

Smile

CC1(CC2=C(CO1)C(=C3C(=CC(=O)C(=C3C(=O)O)O)O2)O)O

DOS

IR

Vibrations