Geometry & MOs

Info

ID:	191046
PubChem CID:	78099719
Reduced:	SO4H16C19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	384.136159
ΔH_f, kcal/mol:	-92.2
Dipole, Da:	3.96
IP(EA), eV:	-9.29(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4'-naphthalen-1-yl-2-oxospiro[1-benzofuran-3,5'-cyclopentene]-1'-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=CCC(C12C3=CC=CC=C3OC2=O)C4=CC=CS4

DOS

IR

Vibrations