Geometry & MOs

Info

ID:	310018
PubChem CID:	126572859
Reduced:	FN2O3C18H19 (1)
Stoich.:	AB2C3D18E19 (1)
Weight, g/mol:	454.141638
ΔH_f, kcal/mol:	-117.82
Dipole, Da:	7.74
IP(EA), eV:	-9.56(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl 2,5-bis(1-benzofuran-2-yl)benzene-1,4-dicarboxylate

Drug info:

PubChemData

Smile

CC1(CCC=C1C2=C(N=CN2C3=C(C=CC(=C3)OC)F)C(=O)O)C

DOS

IR

Vibrations