Geometry & MOs

Info

ID:	31817
PubChem CID:	3719647
Reduced:	FNO4H20C28 (1)
Stoich.:	ABC4D20E28 (1)
Weight, g/mol:	417.078327
ΔH_f, kcal/mol:	-90.75
Dipole, Da:	4.83
IP(EA), eV:	-8.38(-1.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(furan-2-carbonyl)-4-hydroxy-1-(5-methyl-1,3,4-thiadiazol-2-yl)-2-naphthalen-1-yl-2H-pyrrol-5-one

Drug info:

PubChemData

Smile

COC(=O)C1C(C2(C3N1C4=CC=CC=C4C=C3)C(=O)C5=CC=CC=C5C2=O)C6=CC=C(C=C6)F

DOS

IR

Vibrations