Geometry & MOs

Info

ID:	259560
PubChem CID:	103168087
Reduced:	ON3C11H17 (1)
Stoich.:	AB3C11D17 (1)
Weight, g/mol:	276.116173
ΔH_f, kcal/mol:	5.31
Dipole, Da:	3.18
IP(EA), eV:	-10.49(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-ethoxycyclobutyl)-1-(5-fluoro-1-benzofuran-2-yl)ethanone

Drug info:

PubChemData

Smile

CCCN1C(=CN=N1)C(=O)CC2CCC2

DOS

IR

Vibrations