Geometry & MOs

Info

ID:	7366
PubChem CID:	72277
Reduced:	O7H14C15 (1)
Stoich.:	A7B14C15 (1)
Weight, g/mol:	306.073953
ΔH_f, kcal/mol:	-262.79
Dipole, Da:	2.31
IP(EA), eV:	-8.92(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R,3R)-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol

Drug info:

PubChemData

Smile

C1[C@H]([C@H](OC2=CC(=CC(=C21)O)O)C3=CC(=C(C(=C3)O)O)O)O

DOS

IR

Vibrations