Geometry & MOs

Info

ID:	334405
PubChem CID:	127252957
Reduced:	N2O6C23H26 (1)
Stoich.:	A2B6C23D26 (1)
Weight, g/mol:	476.158351
ΔH_f, kcal/mol:	-196.1
Dipole, Da:	6.49
IP(EA), eV:	-8.62(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[[(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxodibenzofuran-2-ylidene]ethyl]amino]phenyl]acetamide

Drug info:

PubChemData

Smile

CC(C)OC1=CC=C(C=C1)C(=O)NCC2=C3CCN(C(=O)C3=C(C4=C2OCO4)OC)C

DOS

IR

Vibrations