Geometry & MOs

Info

ID:	177390
PubChem CID:	76179931
Reduced:	N2O10H26C29 (1)
Stoich.:	A2B10C26D29 (1)
Weight, g/mol:	322.095357
ΔH_f, kcal/mol:	-333.32
Dipole, Da:	5.55
IP(EA), eV:	-9.32(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[hydroxy-(3-methyl-1-benzofuran-2-yl)methylidene]-1,4-dimethyl-2,6-dioxopyridine-3-carbonitrile

Drug info:

PubChemData

Smile

CN(C)C1C2C(C3C(=CC4=CC(=CC=C4)C(=O)O)C5=C(C(=CC=C5)O)C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O)O

DOS

IR

Vibrations