Geometry & MOs

Info

ID:	170291
PubChem CID:	75214673
Reduced:	NO7H21C24 (1)
Stoich.:	AB7C21D24 (1)
Weight, g/mol:	485.147452
ΔH_f, kcal/mol:	-217.28
Dipole, Da:	5.8
IP(EA), eV:	-9.35(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-acetyl-1,7-dihydroxy-3-methoxy-9a-methyl-N-(naphthalen-2-ylmethyl)-9-oxodibenzofuran-4-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=C(C=C2C(C1=O)(C3=C(O2)C(=C(C=C3O)OC)C(=O)NCC4=CC=CC=C4)C)O

DOS

IR

Vibrations