Geometry & MOs

Info

ID:	220671
PubChem CID:	85202056
Reduced:	N3F6O8C22H27 (1)
Stoich.:	A3B6C8D22E27 (1)
Weight, g/mol:	576.184291
ΔH_f, kcal/mol:	-673.29
Dipole, Da:	3.75
IP(EA), eV:	-9.83(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4,5-dihydroxy-6-methyl-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]oxy-5-hydroxy-7-methoxy-2-phenylchromen-4-one

Drug info:

PubChemData

Smile

CC(C(=O)NC(C(CC(=O)OC)O)C(F)(F)F)NC(=O)CC(C(C(F)(F)F)NC(=O)OCC1=CC=CC=C1)O

DOS

IR

Vibrations