Geometry & MOs

Info

ID:	4022
PubChem CID:	10603
Reduced:	O3H7C8 (2)
Stoich.:	A3B7C8 (2)
Weight, g/mol:	302.079038
ΔH_f, kcal/mol:	-198.45
Dipole, Da:	3.62
IP(EA), eV:	-8.61(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7,11b-dihydro-6H-indeno[2,1-c]chromene-3,4,6a,9,10-pentol

Drug info:

PubChemData

Smile

C1C2=CC(=C(C=C2C3C1(COC4=C3C=CC(=C4O)O)O)O)O

DOS

IR

Vibrations