Geometry & MOs

Info

ID:	334384
PubChem CID:	127252936
Reduced:	N3O5C23H25 (1)
Stoich.:	A3B5C23D25 (1)
Weight, g/mol:	502.126382
ΔH_f, kcal/mol:	-154.43
Dipole, Da:	5.1
IP(EA), eV:	-8.17(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[2-(3,4-dihydroxyphenyl)-8-(2,4-dimethylphenyl)-3,5-dihydroxy-4-oxofuro[2,3-h]chromen-9-yl]acetate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CC2=CC(=C(C=C2C[C@H]1C(=O)N)OC)OC)N3CC4=CC=CC=C4C3=O

DOS

IR

Vibrations